3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]propanamide
Chemical Structure Depiction of
3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]propanamide
3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | C741-0221 |
| Compound Name: | 3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-[2-(2-methylpiperidin-1-yl)ethyl]propanamide |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C27 H31 F N6 O2 |
| Smiles: | CC1CCCCN1CCNC(CCc1nnc2N(Cc3ccc(cc3)F)C(c3ccccc3n12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0067 |
| logD: | 0.0338 |
| logSw: | -2.8379 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.452 |
| InChI Key: | ZXGYQCVRHSIEJB-IBGZPJMESA-N |