N-(2-chloro-4-methylphenyl)-2-[4-(2-methylpropyl)-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-[4-(2-methylpropyl)-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetamide
N-(2-chloro-4-methylphenyl)-2-[4-(2-methylpropyl)-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetamide
Compound characteristics
| Compound ID: | F365-0047 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-[4-(2-methylpropyl)-1,5-dioxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-2(1H)-yl]acetamide |
| Molecular Weight: | 439.9 |
| Molecular Formula: | C22 H22 Cl N5 O3 |
| Smiles: | CC(C)CN1C2=NN(CC(Nc3ccc(C)cc3[Cl])=O)C(N2c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9708 |
| logD: | 3.9707 |
| logSw: | -4.2299 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.658 |
| InChI Key: | ADLOUEHEAKHUPW-UHFFFAOYSA-N |