7-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
7-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | V002-7230 |
| Compound Name: | 7-[4-(4-butylbenzene-1-sulfonyl)piperazin-1-yl]-6-(4-methoxyphenyl)[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 506.63 |
| Molecular Formula: | C26 H30 N6 O3 S |
| Salt: | not_available |
| Smiles: | CCCCc1ccc(cc1)S(N1CCN(CC1)c1c(cnc2ncnn12)c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.137 |
| logD: | 5.1275 |
| logSw: | -5.0119 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.311 |
| InChI Key: | PKRTYAYEBXALDX-UHFFFAOYSA-N |