5-chloro-N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
5-chloro-N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzene-1-sulfonamide
5-chloro-N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L283-0121 |
| Compound Name: | 5-chloro-N-{4-[(6-ethyl-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-2-methoxybenzene-1-sulfonamide |
| Molecular Weight: | 490 |
| Molecular Formula: | C21 H20 Cl N5 O3 S2 |
| Smiles: | CCc1c(C)nc2ncnn2c1Sc1ccc(cc1)NS(c1cc(ccc1OC)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5936 |
| logD: | 4.5698 |
| logSw: | -4.6502 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.576 |
| InChI Key: | TWUBHJYZRQVINL-UHFFFAOYSA-N |