Basic information
- Standard SMILES
Cc1ccccc1-c1ccc(C(=O)N2Cc3cccn3Cc3ccccc32)cc1C- InChIKey
XDZHFZZYOIIMPG-UHFFFAOYSA-N- Molecular formula
- C27H24N2O
- Average molar mass
- 392.5 g/mol
Names & identifiers
- Preferred name
- (10,11-Dihydro-5H-pyrrolo[2,1-c](1,4]benzodiazepin-10-yl)-(2,2'-dimethyl-biphenyl-4-yl)-methanone
- IUPAC
- 6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl-[3-methyl-4-(2-methylphenyl)phenyl]methanone
Names & synonyms
(10,11-Dihydro-5H-pyrrolo[2,1-c](1,4]benzodiazepin-10-yl)-(2,2'-dimethyl-biphenyl-4-yl)-methanone(10,11-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-yl)-(2,2'-dimethyl-biphenyl-4-yl)-methanoneSCHEMBL3535343XDZHFZZYOIIMPG-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 68680291
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 606
Related reactions
9 records
Compound notes
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