N-[2-methyl-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-methyl-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
N-[2-methyl-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 7888-0913 |
| Compound Name: | N-[2-methyl-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C28 H28 N4 O4 |
| Smiles: | CC1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(Nc1cc(ccc1C)c1nc2cc(C)ccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0886 |
| logD: | 6.0881 |
| logSw: | -5.4046 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.674 |
| InChI Key: | VXCDTCFDGZMHTA-UHFFFAOYSA-N |