N-cyclopentyl-3-[1-{[(2-fluorophenyl)methyl]sulfanyl}-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
Chemical Structure Depiction of
N-cyclopentyl-3-[1-{[(2-fluorophenyl)methyl]sulfanyl}-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
N-cyclopentyl-3-[1-{[(2-fluorophenyl)methyl]sulfanyl}-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
Compound characteristics
| Compound ID: | L942-0106 |
| Compound Name: | N-cyclopentyl-3-[1-{[(2-fluorophenyl)methyl]sulfanyl}-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C24 H24 F N5 O2 S |
| Smiles: | C1CCC(C1)NC(CCN1C(c2ccccc2n2c1nnc2SCc1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8152 |
| logD: | 3.8152 |
| logSw: | -4.0252 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.853 |
| InChI Key: | XIGSKSYWJISHJS-UHFFFAOYSA-N |