4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[4-(propan-2-yl)phenyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[4-(propan-2-yl)phenyl]cyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[4-(propan-2-yl)phenyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C548-3560 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[4-(propan-2-yl)phenyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 472.63 |
| Molecular Formula: | C23 H28 N4 O3 S2 |
| Smiles: | CC(C)c1ccc(cc1)NC(C1CCC(CC1)CNS(c1cccc2c1nsn2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2123 |
| logD: | 5.2107 |
| logSw: | -5.0539 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.233 |
| InChI Key: | DKFQBWXRLVUTPS-UHFFFAOYSA-N |