3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-cycloheptylpropanamide
Chemical Structure Depiction of
3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-cycloheptylpropanamide
3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-cycloheptylpropanamide
Compound characteristics
| Compound ID: | C741-0612 |
| Compound Name: | 3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-cycloheptylpropanamide |
| Molecular Weight: | 477.99 |
| Molecular Formula: | C26 H28 Cl N5 O2 |
| Smiles: | C1CCCC(CC1)NC(CCc1nnc2N(Cc3ccc(cc3)[Cl])C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3344 |
| logD: | 4.3344 |
| logSw: | -4.7338 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.234 |
| InChI Key: | MBWKQSTXRQTOBN-UHFFFAOYSA-N |