N-[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitrobenzamide
N-[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1550-0383 |
| Compound Name: | N-[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitrobenzamide |
| Molecular Weight: | 442.26 |
| Molecular Formula: | C21 H13 Cl2 N3 O4 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(Nc1ccc2c(c1)nc(c1cccc(c1[Cl])[Cl])o2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0988 |
| logD: | 6.0926 |
| logSw: | -6.3134 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.22 |
| InChI Key: | GCQTZLUUGNXKBM-UHFFFAOYSA-N |