2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | F399-0671 |
| Compound Name: | 2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-3-[(4-methylphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C26 H21 N3 O3 S2 |
| Smiles: | Cc1ccc(CN2C(=Nc3c4cccnc4sc3C2=O)SCC(c2ccc(cc2)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.185 |
| logD: | 5.185 |
| logSw: | -5.1091 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.462 |
| InChI Key: | JUPKQZWRDGAVHV-UHFFFAOYSA-N |