2-[2-(3-chlorophenyl)-2-oxoethyl]-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
2-[2-(3-chlorophenyl)-2-oxoethyl]-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
2-[2-(3-chlorophenyl)-2-oxoethyl]-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F366-0042 |
| Compound Name: | 2-[2-(3-chlorophenyl)-2-oxoethyl]-4-(2-methylpropyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 410.86 |
| Molecular Formula: | C21 H19 Cl N4 O3 |
| Smiles: | CC(C)CN1C2=NN(CC(c3cccc(c3)[Cl])=O)C(N2c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0449 |
| logD: | 4.0449 |
| logSw: | -4.3822 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.454 |
| InChI Key: | JAFSGOKHIJDIKD-UHFFFAOYSA-N |