9-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | Y020-1244 |
| Compound Name: | 9-phenyl-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C18 H18 N4 O S |
| Smiles: | C=CCSc1nc2NC3CCCC(C=3C(c3ccccc3)n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7996 |
| logD: | 3.7377 |
| logSw: | -4.0583 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.338 |
| InChI Key: | WFGBLHRPOUFJDP-INIZCTEOSA-N |