N-(2-methylpropyl)-3-(5-oxo-1-sulfanylidene-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl)propanamide
Chemical Structure Depiction of
N-(2-methylpropyl)-3-(5-oxo-1-sulfanylidene-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl)propanamide
N-(2-methylpropyl)-3-(5-oxo-1-sulfanylidene-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl)propanamide
Compound characteristics
| Compound ID: | C200-9439 |
| Compound Name: | N-(2-methylpropyl)-3-(5-oxo-1-sulfanylidene-1,2-dihydro[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl)propanamide |
| Molecular Weight: | 345.42 |
| Molecular Formula: | C16 H19 N5 O2 S |
| Smiles: | CC(C)CNC(CCN1C2=NNC(N2c2ccccc2C1=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5314 |
| logD: | -5.7254 |
| logSw: | -2.4778 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.096 |
| InChI Key: | USTNJZLAIQFDOY-UHFFFAOYSA-N |