8-chloro-5-[4-(ethanesulfonyl)piperazin-1-yl]-3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
Chemical Structure Depiction of
8-chloro-5-[4-(ethanesulfonyl)piperazin-1-yl]-3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
8-chloro-5-[4-(ethanesulfonyl)piperazin-1-yl]-3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline
Compound characteristics
| Compound ID: | V017-2187 |
| Compound Name: | 8-chloro-5-[4-(ethanesulfonyl)piperazin-1-yl]-3-(2-methylphenyl)[1,2,4]triazolo[4,3-c]quinazoline |
| Molecular Weight: | 470.98 |
| Molecular Formula: | C22 H23 Cl N6 O2 S |
| Salt: | not_available |
| Smiles: | CCS(N1CCN(CC1)c1nc2cc(ccc2c2nnc(c3ccccc3C)n12)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.203 |
| logD: | 4.0938 |
| logSw: | -4.5262 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.678 |
| InChI Key: | ZYCIRKDJRBLFJT-UHFFFAOYSA-N |