Basic information
- Standard SMILES
O=C(NCC1CCCO1)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)N1CCC(N2CCOCC2)CC1)=Cc1ccccc1-3- InChIKey
GFAFWCJVGHTHAQ-UHFFFAOYSA-N- Molecular formula
- C39H48N4O4
- Average molar mass
- 636.8 g/mol
- Monoisotopic mass
- 636.36755603
Names & identifiers
- IUPAC
- 13-cyclohexyl-6-(4-morpholin-4-ylpiperidine-1-carbonyl)-N-(oxolan-2-ylmethyl)-7H-indolo[2,1-a][2]benzazepine-10-carboxamide
Database identifiers
- PubChem CID
- 76556085
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,130
Related reactions
1 records
Compound notes
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