3-(4-methylbenzene-1-sulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline
Chemical Structure Depiction of
3-(4-methylbenzene-1-sulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline
3-(4-methylbenzene-1-sulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline
Compound characteristics
| Compound ID: | E694-0075 |
| Compound Name: | 3-(4-methylbenzene-1-sulfonyl)-5-[4-(4-nitrophenyl)piperazin-1-yl][1,2,3]triazolo[1,5-a]quinazoline |
| Molecular Weight: | 529.58 |
| Molecular Formula: | C26 H23 N7 O4 S |
| Smiles: | Cc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3142 |
| logD: | 5.3142 |
| logSw: | -5.5426 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 101.77 |
| InChI Key: | MIIGQHWVVIVRQY-UHFFFAOYSA-N |