{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}(phenyl)methanone
{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | V020-0216 |
| Compound Name: | {4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}(phenyl)methanone |
| Molecular Weight: | 497 |
| Molecular Formula: | C28 H25 Cl N6 O |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(c1ccccc1)=O)c1nc2cc(ccc2c2nnc(c3ccc(C)cc3)n12)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0377 |
| logD: | 5.9726 |
| logSw: | -6.1668 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.668 |
| InChI Key: | NEXLCORRDLNFIT-IBGZPJMESA-N |