3-(benzenesulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline
Chemical Structure Depiction of
3-(benzenesulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline
3-(benzenesulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline
Compound characteristics
| Compound ID: | E694-0158 |
| Compound Name: | 3-(benzenesulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline |
| Molecular Weight: | 515.55 |
| Molecular Formula: | C25 H21 N7 O4 S |
| Smiles: | C1CN(CCN1c1ccc(cc1)[N+]([O-])=O)c1c2ccccc2n2c(c(nn2)S(c2ccccc2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7058 |
| logD: | 4.7058 |
| logSw: | -4.7667 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 101.77 |
| InChI Key: | LLGWSLRRYLFQSZ-UHFFFAOYSA-N |