2-cyano-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide
2-cyano-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | 4086-0608 |
| Compound Name: | 2-cyano-3-{1-[(4-methylphenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C25 H25 N3 O2 |
| Smiles: | Cc1ccc(Cn2cc(/C=C(/C#N)C(NCC3CCCO3)=O)c3ccccc23)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6015 |
| logD: | 3.6014 |
| logSw: | -3.5042 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.095 |
| InChI Key: | LNIJCRQRWNRDDS-JOCHJYFZSA-N |