4-(4-methoxyphenyl)-7-(propan-2-yl)-1-[(prop-2-en-1-yl)sulfanyl]-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-(4-methoxyphenyl)-7-(propan-2-yl)-1-[(prop-2-en-1-yl)sulfanyl]-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-(4-methoxyphenyl)-7-(propan-2-yl)-1-[(prop-2-en-1-yl)sulfanyl]-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | 6280-0837 |
| Compound Name: | 4-(4-methoxyphenyl)-7-(propan-2-yl)-1-[(prop-2-en-1-yl)sulfanyl]-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 468.6 |
| Molecular Formula: | C23 H24 N4 O3 S2 |
| Smiles: | CC(C)C1Cc2c3C(N(c4ccc(cc4)OC)c4nnc(n4c3sc2CO1)SCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8554 |
| logD: | 4.8554 |
| logSw: | -4.7857 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.24 |
| InChI Key: | SHVSDJLABFRIAU-QGZVFWFLSA-N |