N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide
N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 7840-3089 |
| Compound Name: | N-[2-chloro-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-3-(3-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 433.85 |
| Molecular Formula: | C23 H16 Cl N3 O4 |
| Smiles: | Cc1ccc2c(c1)oc(c1ccc(c(c1)NC(/C=C/c1cccc(c1)[N+]([O-])=O)=O)[Cl])n2 |
| Stereo: | ACHIRAL |
| logP: | 6.143 |
| logD: | 6.1429 |
| logSw: | -6.2792 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.61 |
| InChI Key: | NGXHILMUBUOZKJ-UHFFFAOYSA-N |