4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-methylcyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-methylcyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-methylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C548-3513 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-methylcyclohexane-1-carboxamide |
| Molecular Weight: | 450.62 |
| Molecular Formula: | C21 H30 N4 O3 S2 |
| Smiles: | CN(C1CCCCC1)C(C1CCC(CC1)CNS(c1cccc2c1nsn2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1911 |
| logD: | 4.1894 |
| logSw: | -4.1887 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.344 |
| InChI Key: | RJBYBRHVEATGBQ-UHFFFAOYSA-N |