N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzene-1-sulfonamide
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L283-0065 |
| Compound Name: | N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C20 H19 N5 O2 S2 |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(cc1)Sc1c(C)c(C)nc2ncnn12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2332 |
| logD: | 4.2093 |
| logSw: | -4.2213 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.945 |
| InChI Key: | IRLJEWHNYVJNRD-UHFFFAOYSA-N |