4-chloro-N-{2-[(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]cyclohexyl}benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-{2-[(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]cyclohexyl}benzene-1-sulfonamide
4-chloro-N-{2-[(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]cyclohexyl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 6691-0355 |
| Compound Name: | 4-chloro-N-{2-[(5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl)sulfanyl]cyclohexyl}benzene-1-sulfonamide |
| Molecular Weight: | 452 |
| Molecular Formula: | C19 H22 Cl N5 O2 S2 |
| Smiles: | Cc1cc(C)n2c(nnc2n1)SC1CCCCC1NS(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9791 |
| logD: | 3.979 |
| logSw: | -4.2513 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.74 |
| InChI Key: | OELUTNPIDVZVQC-UHFFFAOYSA-N |