Basic information
- Standard SMILES
O=C(O)c1nc(-c2ccccc2)n2c1CCCCC2- InChIKey
UOFZDTQOLKIQKV-UHFFFAOYSA-N- Molecular formula
- C15H16N2O2
- Average molar mass
- 256.3 g/mol
Names & identifiers
- Preferred name
- 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylic acid
- IUPAC
- 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylic acid
Names & synonyms
109650-67-13-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylic acid3-phenyl-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carboxylic acidMFCD09971640SCHEMBL342860UOFZDTQOLKIQKV-UHFFFAOYSA-NAKOS023166205BS-4708CS-0246608EN300-33397G24681Z351042866
Show more names
3-phenyl-5H,6H,7H,8H,9H-imidazo[1,5-a]azepine-1-carboxylicacid
Database identifiers
- PubChem CID
- 25342175
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 328
Related reactions
3 records
Compound notes
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