3-[(2-ethoxyphenyl)methyl]-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-[(2-ethoxyphenyl)methyl]-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
3-[(2-ethoxyphenyl)methyl]-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0516 |
| Compound Name: | 3-[(2-ethoxyphenyl)methyl]-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 501.63 |
| Molecular Formula: | C27 H23 N3 O3 S2 |
| Smiles: | CCOc1ccccc1CN1C(=Nc2c3cccnc3sc2C1=O)SCC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5427 |
| logD: | 5.5427 |
| logSw: | -5.591 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.129 |
| InChI Key: | LDELSHIRMFYKKG-UHFFFAOYSA-N |