7-[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | G867-0062 |
| Compound Name: | 7-[4-(3,4-dimethylbenzene-1-sulfonyl)piperazin-1-yl]-3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 463.56 |
| Molecular Formula: | C23 H25 N7 O2 S |
| Smiles: | Cc1ccc(cc1)n1c2c(c(ncn2)N2CCN(CC2)S(c2ccc(C)c(C)c2)(=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.3552 |
| logD: | 4.3551 |
| logSw: | -4.2472 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.144 |
| InChI Key: | XBQIOFOZXOMZQE-UHFFFAOYSA-N |