7-[4-(2,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-[4-(2,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-[4-(2,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0196 |
| Compound Name: | 7-[4-(2,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 479.56 |
| Molecular Formula: | C23 H25 N7 O3 S |
| Smiles: | Cc1ccc(c(C)c1)S(N1CCN(CC1)c1c2c(ncn1)n(c1cccc(c1)OC)nn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9085 |
| logD: | 3.9084 |
| logSw: | -3.9732 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.688 |
| InChI Key: | YSGHHFGRAONDPF-UHFFFAOYSA-N |