N-(butan-2-yl)-3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
Chemical Structure Depiction of
N-(butan-2-yl)-3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
N-(butan-2-yl)-3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide
Compound characteristics
| Compound ID: | C741-0607 |
| Compound Name: | N-(butan-2-yl)-3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}propanamide |
| Molecular Weight: | 437.93 |
| Molecular Formula: | C23 H24 Cl N5 O2 |
| Smiles: | CCC(C)NC(CCc1nnc2N(Cc3ccc(cc3)[Cl])C(c3ccccc3n12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0898 |
| logD: | 3.0898 |
| logSw: | -3.7887 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.891 |
| InChI Key: | PYNVGFCFDOZDAC-HNNXBMFYSA-N |