N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2,5-dimethoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2,5-dimethoxybenzene-1-sulfonamide
N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2,5-dimethoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L283-0056 |
| Compound Name: | N-{4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2,5-dimethoxybenzene-1-sulfonamide |
| Molecular Weight: | 471.56 |
| Molecular Formula: | C21 H21 N5 O4 S2 |
| Smiles: | Cc1c(C)nc2ncnn2c1Sc1ccc(cc1)NS(c1cc(ccc1OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6361 |
| logD: | 3.6285 |
| logSw: | -4.0545 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.119 |
| InChI Key: | KUEHMRSDCBWHCL-UHFFFAOYSA-N |