N-(butan-2-yl)-3-[5-oxo-1-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
					Chemical Structure Depiction of
N-(butan-2-yl)-3-[5-oxo-1-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
			N-(butan-2-yl)-3-[5-oxo-1-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide
Compound characteristics
| Compound ID: | L942-0097 | 
| Compound Name: | N-(butan-2-yl)-3-[5-oxo-1-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]propanamide | 
| Molecular Weight: | 444.55 | 
| Molecular Formula: | C21 H28 N6 O3 S | 
| Smiles: | CCC(C)NC(CCN1C(c2ccccc2n2c1nnc2SCC(NC(C)C)=O)=O)=O | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 1.3928 | 
| logD: | 1.3928 | 
| logSw: | -2.3868 | 
| Hydrogen bond acceptors count: | 9 | 
| Hydrogen bond donors count: | 2 | 
| Polar surface area: | 87.192 | 
| InChI Key: | MVTQEIXZVVCLBJ-AWEZNQCLSA-N | 
 
				 
				