2-cyano-3-{1-[(3,4-dichlorophenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide
Chemical Structure Depiction of
2-cyano-3-{1-[(3,4-dichlorophenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide
2-cyano-3-{1-[(3,4-dichlorophenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide
Compound characteristics
| Compound ID: | 4086-0609 |
| Compound Name: | 2-cyano-3-{1-[(3,4-dichlorophenyl)methyl]-1H-indol-3-yl}-N-[(oxolan-2-yl)methyl]prop-2-enamide |
| Molecular Weight: | 454.35 |
| Molecular Formula: | C24 H21 Cl2 N3 O2 |
| Smiles: | C1CC(CNC(C(=C/c2cn(Cc3ccc(c(c3)[Cl])[Cl])c3ccccc23)\C#N)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4952 |
| logD: | 4.4951 |
| logSw: | -4.4958 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.095 |
| InChI Key: | VKVLUHUEMZZPIV-LJQANCHMSA-N |