1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-2-methoxyethan-1-one
Chemical Structure Depiction of
1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-2-methoxyethan-1-one
1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-2-methoxyethan-1-one
Compound characteristics
| Compound ID: | V017-2196 |
| Compound Name: | 1-{4-[8-chloro-3-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]-2-methylpiperazin-1-yl}-2-methoxyethan-1-one |
| Molecular Weight: | 464.95 |
| Molecular Formula: | C24 H25 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(COC)=O)c1nc2cc(ccc2c2nnc(c3ccc(C)cc3)n12)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3419 |
| logD: | 4.2768 |
| logSw: | -4.5744 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.836 |
| InChI Key: | GHVUYCKHGDXRLC-INIZCTEOSA-N |