API and parent drug

Bisacodyl

CAS 603-50-9 · C22H19NO4 · 7 related records

01API identity and structure

2D structurePubChem CID 2391
2D structure: Bisacodyl, CAS 603-50-9
Structure of Bisacodyl (CAS 603-50-9). LazyChem record. Source identity: PubChem CID 2391. Confirm the identifiers before analytical use.Download structure image
API / medicine nameBisacodyl
CAS RN603-50-9
PubChem CID2391
Molecular formulaC22H19NO4
Molecular weight361.4 g/mol
IUPAC name[4-[(4-acetyloxyphenyl)-pyridin-2-ylmethyl]phenyl] acetate
Defined stereocentres0
Unassigned stereocentres0
SMILESCC(=O)OC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC(=O)C)C3=CC=CC=N3
InChINot listed
InChIKeyKHOITXIGCFIULA-UHFFFAOYSA-N

02Structural nitrosamine screen

Record-level resultNo candidate is published

No record-level structural candidate is currently published for this identity.

This result does not predict manufacturing conditions, formation, analytical findings or absence of risk. A process-specific assessment is required.

03India status for this compound

The result below applies only to this exact compound identity and CAS number.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESNo exact reviewed identity entry was found. Generic, class, analogue, salt and isomer provisions were not evaluated. Confirm the current official schedule before a regulatory decision.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 603-50-9 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Sources