N-(3,5-dimethylphenyl)-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
N-(3,5-dimethylphenyl)-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
Compound characteristics
| Compound ID: | C741-0503 |
| Compound Name: | N-(3,5-dimethylphenyl)-3-{4-[(4-fluorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide |
| Molecular Weight: | 469.52 |
| Molecular Formula: | C27 H24 F N5 O2 |
| Smiles: | Cc1cc(C)cc(c1)NC(CCc1nnc2N(Cc3ccc(cc3)F)C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9213 |
| logD: | 3.9213 |
| logSw: | -4.0528 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.856 |
| InChI Key: | IKIVUFYVGDLSOE-UHFFFAOYSA-N |