9-(4-hydroxyphenyl)-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-(4-hydroxyphenyl)-2-[(prop-2-en-1-yl)sulfanyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(4-hydroxyphenyl)-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: | Y020-1246 |
| Compound Name: | 9-(4-hydroxyphenyl)-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: | 354.43 |
| Molecular Formula: | C18 H18 N4 O2 S |
| Smiles: | C=CCSc1nc2NC3CCCC(C=3C(c3ccc(cc3)O)n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1755 |
| logD: | 3.1136 |
| logSw: | -3.4352 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.955 |
| InChI Key: | BVIGFKMJZYWLSY-INIZCTEOSA-N |