5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V017-7636 |
| Compound Name: | 5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 498.61 |
| Molecular Formula: | C27 H26 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)c1nc2ccccc2c2nnc(c3cccc(C)c3)n12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3717 |
| logD: | 5.1049 |
| logSw: | -5.8036 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.512 |
| InChI Key: | QLAWZPQKHOVJRT-UHFFFAOYSA-N |