Identità

Bicalutamide Impurity P

CAS 937802-59-0 · C17H14F4N2O6S

01Identità

Lazychem IDLC-08213
CAS RN937802-59-0
PubChem CID44444333
Molecular formulaC17H14F4N2O6S
Molecular weight450.36 g/mol
IUPAC name(R)-3-((4-fluorophenyl)sulfonyl)-2-hydroxy-2-methyl-N-(4-nitro-3-(trifluoromethyl)phenyl)propanamide
InChIKeyZMBWZDLDJNBWBB-INIZCTEOSA-N

02Struttura e stereochimica

2D structurePubChem CID 44444333
Two-dimensional chemical structure of Bicalutamide Impurity P, CAS 937802-59-0
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 1 defined stereocentre, contains at least one halogen atom, contains a nitro substructure. These statements are calculated from the published structure string.

Defined stereocentres1
Ring count2
Secondary amines0
Tertiary amines0
SMILESC[C@](CS(=O)(=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)O
InChINon indicato

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

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.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

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.

04Stato in India

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

05Nomi e relazioni

API e farmaco progenitore

Bicalutamide

Impurezze e composti correlati

Nomi e relazioni

  • (2R)-3-(4-fluorophenyl)sulfonyl-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
  • CHEMBL250997
  • SCHEMBL17381239
  • ZMBWZDLDJNBWBB-INIZCTEOSA-N
  • BDBM239507
  • 937802-59-0
  • US10053433, FC 4.125

Impurezze e composti correlati

06Fonti