• Search chemicals, activators, Inhibitors, APIs, intermediates and raw materials.

426219-18-3 (Orteronel (racemate))

1

Identification

Orteronel (racemate) Orteronel (racemate)
Name Orteronel (racemate)
Formula C18H17N3O2
MW 307.3465
CAS No. 426219-18-3
EINECS
Smiles O=C(C1=CC=C2C=C(C3(O)CCN4C=NC=C43)C=CC2=C1)NC
Synonyms TAK 700 racemate
InChI InChI=1S/C18H17N3O2/c1-19-17(22)14-3-2-13-9-15(5-4-12(13)8-14)18(23)6-7-21-11-20-10-16(18)21/h2-5,8-11,23H,6-7H2,1H3,(H,19,22)
2

Introduction

Orteronel racemate is a highly selective 17,20-lyase inhibitor with IC50 of 38 and 54 nM for human and rat 17, 20-Lyase, respectively. Orteronel racemate shows less active than Orteronel (IC50, 19 and 48 nM for human and rat 17, 20-Lyase, respectively).

Background Information

TAK-700 (Orteronel) is a potent and highly selective human 17,20-lyase inhibitor with IC50 of 38 nM, exhibits >1000-fold selectivity over other CYPs (e.g. 11-hydroxylase and CYP3A4). It completed two phase III clinical trials for metastatic, hormone-refra ......by BOC Sciences
TAK-700 (Orteronel) is a potent and highly selective human 17,20-lyase inhibitor with IC50 of 38 nM, exhibits >1000-fold selectivity over other CYPs (e.g. 11-hydroxylase and CYP3A4). Phase 3. ......by Selleck Chemicals LLC
TAK-700 (Orteronel) is a potent and highly selective human 17,20-lyase inhibitor with IC50 of 38 nM, exhibits >1000-fold selectivity over other CYPs (e.g. 11-hydroxylase and CYP3A4). Phase 3. ......by Target Molecule Corp.
3

Protocol(Only for Reference)

Cell Experiment

Animal Experiment

Animal Models Adult male cynomolgus monkeys.
Dosage ≤1 mg/kg
Formulation TAK-700 is dissolved in 0.5% methylcellulose.
Administration Administered via p.o.
Source Selleck Chemicals LLC
4

Physical and Chemical Properties

Appearance: EBNumber:EB000028744

Storage condition

Solubility

(25°C) * In vitro DMSO 61 mg/mL (198.47 mM); Ethanol8 mg/mL (26.02 mM); Water<1 mg/mL (<1 mM); In vivo 0.5% methylcellulose30 mg/mL by Selleck Chemicals LLC
5

Mechanism and Indication

6

Clinical Information

Product Name Sponsor & Collaborators Indications Start Date End Date Phase
Orteronel (racemate) SWOG Metastatic prostate cancer 2013/3/31 2020/7/1 Phase 3 Clinical
Orteronel (racemate) Schweizerische Arbeitsgruppe fuer angewandte Krebsforschung; Swiss Group for Clinical Cancer Research Hormone refractory prostate cancer 2012/9/30 2020/12/31 Phase 3 Clinical
Orteronel (racemate) Radiation Therapy Oncology Group Hormone dependent prostate cancer 2012/5/31 2014/10/1 Phase 3 Clinical
Orteronel (racemate) Millennium Pharmaceuticals Inc; PPD Development (S) Pte Ltd; Takeda Bio Development Center Ltd Hormone refractory prostate cancer 2010/11/30 2013/7/31 Phase 3 Clinical
Orteronel (racemate) Millennium Pharmaceuticals Inc Hormone refractory prostate cancer 2010/10/31 2013/6/30 Phase 3 Clinical
Orteronel (racemate) - No Development Reported
7

Safety Data of Orteronel (racemate)

8

Spectral Information

9

Suppliers List

Company Price and Availability Country/Region
BOC Sciences
Selleck Chemicals LLC 5mg/USD147(In stock);10mM/1mLIn DMSO/USD330(In stock);50mg/USD997(In stock) USA
Shanghai Haoyuan Chemexpress Co., Ltd. 5mg/USD110();10mg/USD165() China
Target Molecule Corp. 2mg/USD71();5mg/USD96();10mg/USD168();25mg/USD318();50mg/USD568() USA
10

Related Products

Other Forms of 426219-18-3

Name CAS No Formula MW
TAK-700 (R-form) 752243-39-3 C18H17N3O2 307.35
TAK-700 (salt) 426219-53-6 C28H28N4O7 532.54

Recommended Compounds in Cytochrome P450

Name CAS No Formula MW
Dafadine-A 1065506-69-5 C23H25N3O3 391.46
VT-464 (racemate) 1375603-36-3 C18H17F4N3O3 399.34
VT-464 1610537-15-9 C18H17F4N3O3 399.34
Isosilybin 72581-71-6 C25H22O10 482.44
Memantine (hydrochloride) 41100-52-1 C12H22ClN 215.76
Clarithromycin 81103-11-9 C38H69NO13 747.95
(+)-Ketoconazole 142128-59-4 C26H28Cl2N4O4 531.43
(+)-Ketoconazole 142128-59-4 C26H28Cl2N4O4 531.4309
Galangin 548-83-4
Bergapten 484-20-8 C12H8O4 216.19
Naringin 10236-47-2 C27H32O14 580.53
Diosmetin 520-34-3 C16H12O6 300.26
Fenofibrate 49562-28-9 C20H21ClO4 360.83
Bergaptol 486-60-2 C11H6O4 202.1629
Talarozole (R enantiomer) 870093-23-5 C21H23N5S 377.5058
Choline Fenofibrate 856676-23-8 C22H28ClNO5 421.91
Talarozole 201410-53-9 C21H23N5S 377.51
Isavuconazole 241479-67-4 C22H17F2N5OS 437.4650864
Cobicistat 1004316-88-4 C40H53N7O5S2 776.02
Methoxsalen 298-81-7 C12H8O4 216.19

Recommended Compounds in Same Indication

Name CAS No Formula MW
TAK-700 (R-form) 752243-39-3 C18H17N3O2 307.35
Olaparib 763113-22-0 C24H23FN4O3 434.46
KX2-391 897016-82-9 C26H29N3O3 431.53
AT-101 90141-22-3 C30H30O8 518.55
Bicalutamide 90357-06-5 C18H14F4N2O4S 430.37
Enzalutamide 915087-33-1 C21H16F4N4O2S 464.44
Tivozanib 475108-18-0 C22H19ClN4O5 454.86
Orteronel 566939-85-3 C18H17N3O2 307.35
Linsitinib 867160-71-2 C26H23N5O 421.49
Fenretinide 65646-68-6 C26H33NO2 391.55
Leuprolide (Acetate) 74381-53-6 C61H88N16O14 1269.45
Retaspimycin 857402-23-4 C31H45N3O8 587.7
Retaspimycin (Hydrochloride) 857402-63-2 C31H46ClN3O8 624.17
Bafetinib 859212-16-1 C30H31F3N8O 576.6154
AT13387 912999-49-6 C24H31N3O3 409.52
Tasquinimod 254964-60-8 C20H17F3N2O4 406.36
TAK-700 (salt) 426219-53-6 C28H28N4O7 532.54
TOK-001 851983-85-2 C26H32N2O 388.55
Cabozantinib 849217-68-1 C28H24FN3O5 501.51
Odanacatib 603139-19-1 C25H27F4N3O3S 525.56
11

Route of Synthesis

12

References

13

More Information

Orteronel (racemate)

Tags: buy 426219-18-3 IC50 | 426219-18-3 price | 426219-18-3 cost | 426219-18-3 solubility | 426219-18-3 purchase | 426219-18-3 manufacturer | 426219-18-3 research buy | 426219-18-3 order | 426219-18-3 MSDS | 426219-18-3 chemical structure | 426219-18-3 Storage condition | 426219-18-3 molecular weight | 426219-18-3 mw | 426219-18-3 datasheet | 426219-18-3 supplier | 426219-18-3 cell line | 426219-18-3 NMR | 426219-18-3 MS | 426219-18-3 IR | 426219-18-3 solubility | 426219-18-3 Safe information | 426219-18-3 Qc and Spectral Information | 426219-18-3 Clinical Information | 426219-18-3 Clinical Trial | 426219-18-3 Route of Synthesis | 426219-18-3 storage condition | 426219-18-3 diseases and conditions | 426219-18-3 flash point | 426219-18-3 boiling point | 426219-18-3 melting point | 426219-18-3 storage condition | 426219-18-3 brand