3-(3,4-dimethylphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
3-(3,4-dimethylphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-1026 |
| Compound Name: | 3-(3,4-dimethylphenyl)-2-{[(3-fluorophenyl)methyl]sulfanyl}thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 396.5 |
| Molecular Formula: | C21 H17 F N2 O S2 |
| Smiles: | Cc1ccc(cc1C)N1C(=Nc2ccsc2C1=O)SCc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.7678 |
| logD: | 5.7678 |
| logSw: | -5.5226 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.1779 |
| InChI Key: | KHLGKXTWNGBODS-UHFFFAOYSA-N |