4-chloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
4-chloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2783-5183 |
| Compound Name: | 4-chloro-N-[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C21 H14 Cl N3 O4 |
| Smiles: | Cc1ccccc1c1nc2cc(ccc2o1)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9883 |
| logD: | 4.8629 |
| logSw: | -5.0622 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.22 |
| InChI Key: | STOZSEJNRIUQNP-UHFFFAOYSA-N |