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(R)-Bicalutamide

(R)-Bicalutamide structure

CAS No:
113299-40-4
Formula:
C18H14F4N2O4S
Chemical Name:
(R)-Bicalutamide
Synonyms:
(R)-(-)-BICALUTAMIDE;(R)-BICALUTAMIDE;N-[4-Cyano-3-(Trifluoromethyl)Phenyl]-3-[(4-Flurophenyl)Thio]-2-Hydroxy-2-Methyl-Propanamide;R-BICALUTIMIDE;(R)-Casodex;Propanamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methyl-, (2R)-;Propanamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methyl-, (R)-;(2R)-N-[4-Cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
Categories:
Chemical Reagents > Organic Reagents

Description

(R)-bicalutamide is a N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide that is the (R)-enantiomer of bicalutamide. It has a role as an androgen antagonist and an antineoplastic agent. It is an enantiomer of a (S)-bicalutamide.

Off-White Crystalline Solid

(R)-Bicalutamide Basic Attributes

Molecular Weight：

430.37

Exact Mass：

430.06104075 g/mol

EC Number：

692-949-8

UNII：

Z9DL98I0AF

Color/Form：

White to Off-White

Characteristics

PSA：

115.64000

XLogP3：

4.03338

Appearance：

Off-white crystalline solid

Density：

1.52±0.1 g/cm3(Predicted)

Melting Point：

178-181°C

Boiling Point：

650.3±55.0 °C(Predicted)

Refractive Index：

1.577

Vapor Pressure：

8.47E-18mmHg at 25°C

PKA：

11.49±0.29(Predicted)

Critical Temperature & Pressure：

-20°C Freezer

Safety Information

GHS Classification：

|Danger|H351 (100%): Suspected of causing cancer [Warning Carcinogenicity]|P201, P202, P273, P281, P308+P313, P391, P405, and P501|Aggregated GHS information provided by 3 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

NifW protein, Bacteria

(R)-Bicalutamide Use and Manufacturing

(R)-Bicalutamide can be used as an antiandrogen, antineoplastic (hormonal).

Computed Properties

Molecular Weight:430.4
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:430.06104075
Monoisotopic Mass:430.06104075
Topological Polar Surface Area:116
Heavy Atom Count:29
Complexity:750
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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