1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-3,3-dimethylbutan-1-one
Chemical Structure Depiction of
1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-3,3-dimethylbutan-1-one
1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-3,3-dimethylbutan-1-one
Compound characteristics
| Compound ID: | V020-4620 |
| Compound Name: | 1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-3,3-dimethylbutan-1-one |
| Molecular Weight: | 477.01 |
| Molecular Formula: | C26 H29 Cl N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1nnc2c3ccc(cc3nc(N3CCN(CC3)C(CC(C)(C)C)=O)n12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.1132 |
| logD: | 6.0481 |
| logSw: | -6.2538 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.193 |
| InChI Key: | ZNDYDHRTEMLZCQ-UHFFFAOYSA-N |