1-{4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylbutan-1-one
Chemical Structure Depiction of
1-{4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylbutan-1-one
1-{4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | V025-0236 |
| Compound Name: | 1-{4-[8-chloro-3-(3-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylbutan-1-one |
| Molecular Weight: | 525.05 |
| Molecular Formula: | C30 H29 Cl N6 O |
| Salt: | not_available |
| Smiles: | CCC(C(N1CCN(CC1)c1nc2cc(ccc2c2nnc(c3cccc(C)c3)n12)[Cl])=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7603 |
| logD: | 6.4796 |
| logSw: | -6.3251 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.449 |
| InChI Key: | MJRGUHYMKFXNFG-XMMPIXPASA-N |