N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide
Chemical Structure Depiction of
N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide
N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide
Compound characteristics
| Compound ID: | 7770-3960 |
| Compound Name: | N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-2-(morpholin-4-yl)-5-nitrobenzamide |
| Molecular Weight: | 492.92 |
| Molecular Formula: | C25 H21 Cl N4 O5 |
| Smiles: | Cc1ccc(cc1NC(c1cc(ccc1N1CCOCC1)[N+]([O-])=O)=O)c1nc2cc(ccc2o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9477 |
| logD: | 4.947 |
| logSw: | -5.0288 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.884 |
| InChI Key: | DOYQHRRMYMSHDY-UHFFFAOYSA-N |