3-[1-(benzylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-(butan-2-yl)propanamide
Chemical Structure Depiction of
3-[1-(benzylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-(butan-2-yl)propanamide
3-[1-(benzylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-(butan-2-yl)propanamide
Compound characteristics
Compound ID: | L942-0083 |
Compound Name: | 3-[1-(benzylsulfanyl)-5-oxo[1,2,4]triazolo[4,3-a]quinazolin-4(5H)-yl]-N-(butan-2-yl)propanamide |
Molecular Weight: | 435.55 |
Molecular Formula: | C23 H25 N5 O2 S |
Smiles: | CCC(C)NC(CCN1C(c2ccccc2n2c1nnc2SCc1ccccc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9577 |
logD: | 2.9577 |
logSw: | -3.6407 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.475 |
InChI Key: | YONVBBMKVQUUKC-INIZCTEOSA-N |