1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylethan-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}-2-phenylethan-1-one
1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylethan-1-one
Compound characteristics
| Compound ID: | V020-4554 |
| Compound Name: | 1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}-2-phenylethan-1-one |
| Molecular Weight: | 497 |
| Molecular Formula: | C28 H25 Cl N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1nnc2c3ccc(cc3nc(N3CCN(CC3)C(Cc3ccccc3)=O)n12)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.9158 |
| logD: | 5.8507 |
| logSw: | -6.1308 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.922 |
| InChI Key: | FAICKFQCRJTHEV-UHFFFAOYSA-N |