N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-3,5-dinitrobenzamide
N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 8005-7705 |
| Compound Name: | N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-3,5-dinitrobenzamide |
| Molecular Weight: | 473.23 |
| Molecular Formula: | C20 H10 Cl2 N4 O6 |
| Smiles: | c1cc(c(cc1c1nc2cc(ccc2o1)NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.7149 |
| logD: | 5.5306 |
| logSw: | -6.175 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.903 |
| InChI Key: | WFILCXDFEALVDG-UHFFFAOYSA-N |