4-(4-methylphenyl)-1-[(2-phenylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
4-(4-methylphenyl)-1-[(2-phenylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
4-(4-methylphenyl)-1-[(2-phenylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | 3379-1828 |
| Compound Name: | 4-(4-methylphenyl)-1-[(2-phenylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 470.61 |
| Molecular Formula: | C26 H22 N4 O S2 |
| Smiles: | Cc1ccc(cc1)N1C(c2c3CCCc3sc2n2c1nnc2SCC(=C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.075 |
| logD: | 6.075 |
| logSw: | -5.5336 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.439 |
| InChI Key: | OXBFDCOKTGOODT-UHFFFAOYSA-N |