Hexanediamide, N-(2-aminophenyl)-N'-phenyl-
Basic information
- CAS
537034-16-5- Standard SMILES
Nc1ccccc1NC(=O)CCCCC(=O)Nc1ccccc1- InChIKey
IDPDDYDPARSMBL-UHFFFAOYSA-N- Molecular formula
- C18H21N3O2
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.16337692
Names & identifiers
- Preferred name
- Hexanediamide, N-(2-aminophenyl)-N'-phenyl-
- IUPAC
- N'-(2-aminophenyl)-N-phenylhexanediamide
Names & synonyms
CHEMBL1221694Hexanediamide, N-(2-aminophenyl)-N'-phenyl-537034-16-5Probes2_000494SCHEMBL1902019DTXSID80429497BDBM50482577N~1~-(2-Aminophenyl)-N~6~-phenylhexanediamide
Database identifiers
- CAS
537034-16-5- PubChem CID
- 9543541
- DTXSID
DTXSID80429497- ChEMBL
CHEMBL1221694
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 380
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Compound notes
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