4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylcyclohexyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylcyclohexyl)cyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylcyclohexyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C548-3573 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylcyclohexyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 464.65 |
| Molecular Formula: | C22 H32 N4 O3 S2 |
| Smiles: | CC1CCCC(C1C)NC(C1CCC(CC1)CNS(c1cccc2c1nsn2)(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0061 |
| logD: | 4.0045 |
| logSw: | -4.0541 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.67 |
| InChI Key: | RMKDQMQWHFIQMY-UHFFFAOYSA-N |