1-(4-{4-[7-chloro-3-(3-methylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[7-chloro-3-(3-methylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[7-chloro-3-(3-methylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | C680-0948 |
| Compound Name: | 1-(4-{4-[7-chloro-3-(3-methylphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 497 |
| Molecular Formula: | C28 H25 Cl N6 O |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)c1c2cc(ccc2n2c(c(c3cccc(C)c3)nn2)n1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1056 |
| logD: | 6.1056 |
| logSw: | -6.1961 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.668 |
| InChI Key: | JIMXTVKUHFGNFE-UHFFFAOYSA-N |