1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one
1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one
Compound characteristics
| Compound ID: | V019-6023 |
| Compound Name: | 1-{4-[3-(4-chlorophenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-3,3-dimethylbutan-1-one |
| Molecular Weight: | 477.01 |
| Molecular Formula: | C26 H29 Cl N6 O |
| Smiles: | CC1CN(CCN1C(CC(C)(C)C)=O)c1nc2ccccc2c2nnc(c3ccc(cc3)[Cl])n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7078 |
| logD: | 5.6467 |
| logSw: | -6.0736 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.412 |
| InChI Key: | JIACVFZQXPNSAN-KRWDZBQOSA-N |