4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-(prop-2-en-1-yl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-(prop-2-en-1-yl)cyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-(prop-2-en-1-yl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C548-3434 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-cyclohexyl-N-(prop-2-en-1-yl)cyclohexane-1-carboxamide |
| Molecular Weight: | 476.66 |
| Molecular Formula: | C23 H32 N4 O3 S2 |
| Smiles: | C=CCN(C1CCCCC1)C(C1CCC(CC1)CNS(c1cccc2c1nsn2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0545 |
| logD: | 5.0529 |
| logSw: | -4.7309 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.576 |
| InChI Key: | DKCNNSDWZRMQNE-UHFFFAOYSA-N |