13-cyclohexyl-6-(morpholine-2-carbonyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-10-carboxylic acid
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Basic information
- Standard SMILES
O=C(O)c1ccc2c(C3CCCCC3)c3n(c2c1)CC(C(=O)C1CNCCO1)Cc1ccccc1-3- InChIKey
GNTDVBXMUGPIQM-UHFFFAOYSA-N- Molecular formula
- C29H32N2O4
- Average molar mass
- 472.6 g/mol
Names & identifiers
- Preferred name
- 13-cyclohexyl-6-(morpholine-2-carbonyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-10-carboxylic acid
- IUPAC
- 13-cyclohexyl-6-(morpholine-2-carbonyl)-6,7-dihydro-5H-indolo[2,1-a][2]benzazepine-10-carboxylic acid
Names & synonyms
SCHEMBL4825577
Database identifiers
- PubChem CID
- 69205437
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 783
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Related reactions
1 records
Compound notes
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