4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[2-(cyclohex-1-en-1-yl)ethyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[2-(cyclohex-1-en-1-yl)ethyl]cyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[2-(cyclohex-1-en-1-yl)ethyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C548-3431 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[2-(cyclohex-1-en-1-yl)ethyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 462.63 |
| Molecular Formula: | C22 H30 N4 O3 S2 |
| Smiles: | C1CCC(CCNC(C2CCC(CC2)CNS(c2cccc3c2nsn3)(=O)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.107 |
| logD: | 4.1054 |
| logSw: | -4.3103 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.589 |
| InChI Key: | HMKDYXFDMDOXGS-UHFFFAOYSA-N |