2-{[(3-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-0721 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-3-[2-(3,4-dimethoxyphenyl)ethyl]thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 473.01 |
| Molecular Formula: | C23 H21 Cl N2 O3 S2 |
| Smiles: | COc1ccc(CCN2C(=Nc3ccsc3C2=O)SCc2cccc(c2)[Cl])cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.2604 |
| logD: | 5.2604 |
| logSw: | -5.6393 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.029 |
| InChI Key: | YHGIXNSXMHLDSE-UHFFFAOYSA-N |