2-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-nitrobenzamide
2-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | F019-0456 |
| Compound Name: | 2-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-nitrobenzamide |
| Molecular Weight: | 442.26 |
| Molecular Formula: | C21 H13 Cl2 N3 O4 |
| Smiles: | Cc1c(cccc1NC(c1ccc(cc1[Cl])[N+]([O-])=O)=O)c1nc2cc(ccc2o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7647 |
| logD: | 5.7644 |
| logSw: | -6.0066 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.824 |
| InChI Key: | VBXZPHCZWHQENU-UHFFFAOYSA-N |