2-[(prop-2-en-1-yl)sulfanyl]-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
Chemical Structure Depiction of
2-[(prop-2-en-1-yl)sulfanyl]-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
2-[(prop-2-en-1-yl)sulfanyl]-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one
Compound characteristics
Compound ID: | Y021-7234 |
Compound Name: | 2-[(prop-2-en-1-yl)sulfanyl]-6,7-dihydro[1,2,4]triazolo[5,1-b]quinazolin-8(5H)-one |
Molecular Weight: | 260.31 |
Molecular Formula: | C12 H12 N4 O S |
Smiles: | C=CCSc1nc2N=C3CCCC(C3=Cn2n1)=O |
Stereo: | ACHIRAL |
logP: | 1.564 |
logD: | 1.564 |
logSw: | -1.801 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 46.66 |
InChI Key: | KNYUHWMYYUOSAS-UHFFFAOYSA-N |