Chemical identity

O-Acyl of Tolvaptan-II

CAS 1580889-35-5 · C26H24ClN3O3

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-23791
PubChem CID71767693
NameO-Acyl of Tolvaptan-II
CAS RN1580889-35-5
Molecular formulaC26H24ClN3O3
Molecular weight461.94 g/mol
IUPAC name1-(4-amino-2-methylbenzoyl)-7-chloro-2,3-dihydro-1H-benzo[b]azepin-5-yl 4-amino-2-methylbenzoate
InChIKeyVBJOPOPXKGEFCP-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 71767693
Two-dimensional chemical structure of O-Acyl of Tolvaptan-II, CAS 1580889-35-5
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres0
Unassigned stereocentres0
Ring count4
Secondary amines0
Tertiary amines0
N-methyl amine sites0
SMILESO=C(C1=CC=C(N)C=C1C)OC2=CCCN(C(C3=CC=C(N)C=C3C)=O)C4=CC=C(Cl)C=C42
InChINot listed
Formula from structureC26H24ClN3O3
Molecular weight from structure461.94 g/mol

03India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNO EXACT MATCH FOUNDCAS 1580889-35-5 has no exact match in the reviewed published schedule.
SCOMETNO EXACT REVIEWED CAS MATCHCAS 1580889-35-5 has no exact match in the reviewed SCOMET list.
Review date2026-08-01Recheck the current official instruments for the material, concentration, activity and date in question.

04Names and relationships

Associated parent compound

Tolvaptan

View API and impurity family

Other names

  • 4-Amino-2-methylbenzoic acid 1-(4-amino-2-methylbenzoyl)-7-chloro-2, 3-dihydro-1H-benzo[b]azepin-5-yl ester
  • Benzoic acid, 4-amino-2-methyl-, 1-(4-amino-2-methylbenzoyl)-7-chloro-2, 3-dihydro-1H-1-benzazepin-5-yl ester

Related records from the same parent family

05Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

06Sources