2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-[4-(3-nitrobenzamido)cyclohexyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-[4-(3-nitrobenzamido)cyclohexyl]-1,3-thiazole-4-carboxamide
2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-[4-(3-nitrobenzamido)cyclohexyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V015-6603 |
| Compound Name: | 2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-[4-(3-nitrobenzamido)cyclohexyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 536.65 |
| Molecular Formula: | C28 H32 N4 O5 S |
| Smiles: | CC(C)c1ccc(C)cc1OCc1nc(cs1)C(NC1CCC(CC1)NC(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.869 |
| logD: | 5.869 |
| logSw: | -5.456 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.52 |
| InChI Key: | PXSQCCIVQGBQCM-UHFFFAOYSA-N |