1-(3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanoyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanoyl)piperidine-4-carboxamide
1-(3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanoyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C741-0174 |
| Compound Name: | 1-(3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanoyl)piperidine-4-carboxamide |
| Molecular Weight: | 476.51 |
| Molecular Formula: | C25 H25 F N6 O3 |
| Smiles: | C1CN(CCC1C(N)=O)C(CCc1nnc2N(Cc3ccc(cc3)F)C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.901 |
| logD: | 0.901 |
| logSw: | -2.2131 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.158 |
| InChI Key: | BESJXKOKNUGEOQ-UHFFFAOYSA-N |