Basic information
- Standard SMILES
Cc1ccccc1-c1ccc(C(=O)N2Cc3ccc(C(=O)NC(C)CCc4ccccc4)n3Cc3ccccc32)cc1C- InChIKey
BIUPAUFWNGFSNP-UHFFFAOYSA-N- Molecular formula
- C38H37N3O2
- Average molar mass
- 567.7 g/mol
Names & identifiers
- Preferred name
- 10-[(2,2'-Dimethyl-1,1'-biphenyl-4-YL)carbonyl]-N-(1-methyl-3-phenylpropyl)-10,11-dihydro-5H-pyrrolo[2,1-C][1,4]benzodiazepine-3-carboxamide
- IUPAC
- 5-[3-methyl-4-(2-methylphenyl)benzoyl]-N-(4-phenylbutan-2-yl)-6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-9-carboxamide
Names & synonyms
SCHEMBL3536892BIUPAUFWNGFSNP-UHFFFAOYSA-N10-[(2,2'-DIMETHYL-1,1'-BIPHENYL-4-YL)CARBONYL]-N-(1-METHYL-3-PHENYLPROPYL)-10,11-DIHYDRO-5H-PYRROLO[2,1-C][1,4]BENZODIAZEPINE-3-CARBOXAMIDE
Database identifiers
- PubChem CID
- 16038754
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 54.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 932
Related reactions
2 records
Compound notes
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