N-[5-(5-methoxy-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-(piperidin-1-yl)benzamide
Chemical Structure Depiction of
N-[5-(5-methoxy-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-(piperidin-1-yl)benzamide
N-[5-(5-methoxy-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-(piperidin-1-yl)benzamide
Compound characteristics
| Compound ID: | 8188-0905 |
| Compound Name: | N-[5-(5-methoxy-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitro-4-(piperidin-1-yl)benzamide |
| Molecular Weight: | 486.53 |
| Molecular Formula: | C27 H26 N4 O5 |
| Smiles: | Cc1ccc(cc1NC(c1ccc(c(c1)[N+]([O-])=O)N1CCCCC1)=O)c1nc2cc(ccc2o1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.3412 |
| logD: | 5.3406 |
| logSw: | -5.2398 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.218 |
| InChI Key: | ZYBHEBSYCJSQLM-UHFFFAOYSA-N |