4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C548-3438 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-[(pyridin-2-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C20 H23 N5 O3 S2 |
| Smiles: | C1CC(CCC1CNS(c1cccc2c1nsn2)(=O)=O)C(NCc1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6531 |
| logD: | 2.6514 |
| logSw: | -3.0406 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.098 |
| InChI Key: | UVYNEXNDBLMVRF-UHFFFAOYSA-N |