N-(2-methylpropyl)-3-[1-(methylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
Chemical Structure Depiction of
N-(2-methylpropyl)-3-[1-(methylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
N-(2-methylpropyl)-3-[1-(methylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
Compound characteristics
| Compound ID: | L942-0123 |
| Compound Name: | N-(2-methylpropyl)-3-[1-(methylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide |
| Molecular Weight: | 359.45 |
| Molecular Formula: | C17 H21 N5 O2 S |
| Smiles: | CC(C)CNC(CCN1C(c2ccccc2n2c1nnc2SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6458 |
| logD: | 1.6458 |
| logSw: | -2.5559 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.305 |
| InChI Key: | MDWOBPLHVSGRRX-UHFFFAOYSA-N |