3-(4-methoxyphenyl)-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
3-(4-methoxyphenyl)-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline
3-(4-methoxyphenyl)-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V003-5889 |
| Compound Name: | 3-(4-methoxyphenyl)-5-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl][1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 514.61 |
| Molecular Formula: | C27 H26 N6 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)c1nc2ccccc2c2nnc(c3ccc(cc3)OC)n12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9848 |
| logD: | 4.9236 |
| logSw: | -4.8214 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.056 |
| InChI Key: | KOIQCJHGFSJDBH-UHFFFAOYSA-N |