3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-cyclohexylpropanamide
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-cyclohexylpropanamide
3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-cyclohexylpropanamide
Compound characteristics
| Compound ID: | C741-0569 |
| Compound Name: | 3-{4-[(4-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-cyclohexylpropanamide |
| Molecular Weight: | 463.97 |
| Molecular Formula: | C25 H26 Cl N5 O2 |
| Smiles: | C1CCC(CC1)NC(CCc1nnc2N(Cc3ccc(cc3)[Cl])C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8385 |
| logD: | 3.8385 |
| logSw: | -4.5268 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.903 |
| InChI Key: | NKWDULHYGVYNNM-UHFFFAOYSA-N |