Bicalutamide Impurity 6

01Azonosítás

Lazychem ID	LC-37529
CAS RN	Nincs megadva
PubChem CID	76969559
Molecular formula	C18H14F4N2O3S
Molecular weight	414.4 g/mol
IUPAC name	(2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(R)-(4-fluorophenyl)sulfinyl]-2-hydroxy-2-methylpropanamide
InChIKey	MHWPKBKCPXTKJS-YMGMXPECSA-N

02Szerkezet és sztereokémia

Two-dimensional chemical structure of Bicalutamide Impurity 6 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon, has 2 defined stereocentres, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	2
Ring count	2
Secondary amines	0
Tertiary amines	0

SMILES	C[C@](C[S@@](=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O
InChI	Nincs megadva

03Stereochemistry

The published structure contains 2 defined and 0 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres2Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

5 records

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

CAS not listed

MHWPKBKCPXTKJS-YMGMXPECSA-N

Current configuration

Bicalutamide EP Impurity E

CAS not listed

MHWPKBKCPXTKJS-FQSKIORSSA-N

1 defined, 1 unassigned centres

Bicalutamide Impurity 25

CAS not listed

MHWPKBKCPXTKJS-WPUOIDIFSA-N

1 defined, 1 unassigned centres

Bicalutamide Related Compound A/ Bicalutamide Sulfoxide

CAS 945419-64-7

MHWPKBKCPXTKJS-UHFFFAOYSA-N

0 defined, 2 unassigned centres

rel-(R,S)-Bicalutamide Sulfoxide

CAS not listed

MHWPKBKCPXTKJS-HPGBDJQBSA-N

2 defined, 0 unassigned centres

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Indiai státusz

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

Bicalutamide Impurity 6

01Azonosítás

02Szerkezet és sztereokémia

03Stereochemistry

Published same-connectivity configurations