2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-9296 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-[(2-ethoxyphenyl)methyl]pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 522.04 |
| Molecular Formula: | C26 H20 Cl N3 O3 S2 |
| Smiles: | CCOc1ccccc1CN1C(=Nc2c3cccnc3sc2C1=O)SCC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.714 |
| logD: | 5.714 |
| logSw: | -5.9876 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.129 |
| InChI Key: | ZONNHRIOIVCHNI-UHFFFAOYSA-N |