N-[3-(1,3-benzoxazol-2-yl)-4-chlorophenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(1,3-benzoxazol-2-yl)-4-chlorophenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
N-[3-(1,3-benzoxazol-2-yl)-4-chlorophenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8377-0897 |
| Compound Name: | N-[3-(1,3-benzoxazol-2-yl)-4-chlorophenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide |
| Molecular Weight: | 490.95 |
| Molecular Formula: | C26 H23 Cl N4 O4 |
| Smiles: | CC1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(Nc1ccc(c(c1)c1nc2ccccc2o1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4015 |
| logD: | 6.3819 |
| logSw: | -6.1116 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.372 |
| InChI Key: | AJVNSAPCIAXSFM-UHFFFAOYSA-N |