2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-7-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-7-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-7-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | V003-6066 |
| Compound Name: | 2-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-7-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 513.41 |
| Molecular Formula: | C22 H21 Br N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)c1ccnc2nc(nn12)N1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4569 |
| logD: | 4.4568 |
| logSw: | -4.3572 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.111 |
| InChI Key: | QVHSYESNNCRPSR-UHFFFAOYSA-N |