N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide
N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 7833-0497 |
| Compound Name: | N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(4-chloro-3-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 433.85 |
| Molecular Formula: | C23 H16 Cl N3 O4 |
| Smiles: | Cc1ccc(cc1NC(/C=C/c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 5.8505 |
| logD: | 5.8505 |
| logSw: | -6.0978 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.309 |
| InChI Key: | NFYACFJHENZIJJ-UHFFFAOYSA-N |