2-[(2-chloro-6-fluorophenyl)methyl]-4-{3-[(propan-2-yl)oxy]propyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Chemical Structure Depiction of
2-[(2-chloro-6-fluorophenyl)methyl]-4-{3-[(propan-2-yl)oxy]propyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
2-[(2-chloro-6-fluorophenyl)methyl]-4-{3-[(propan-2-yl)oxy]propyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Compound characteristics
| Compound ID: | F366-0115 |
| Compound Name: | 2-[(2-chloro-6-fluorophenyl)methyl]-4-{3-[(propan-2-yl)oxy]propyl}-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione |
| Molecular Weight: | 444.89 |
| Molecular Formula: | C22 H22 Cl F N4 O3 |
| Smiles: | CC(C)OCCCN1C2=NN(Cc3c(cccc3[Cl])F)C(N2c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6998 |
| logD: | 3.6998 |
| logSw: | -4.1566 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.386 |
| InChI Key: | SJTBPCJJGLJIBR-UHFFFAOYSA-N |