2-{[(2-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
2-{[(2-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | K263-0451 |
Compound Name: | 2-{[(2-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
Molecular Weight: | 414.52 |
Molecular Formula: | C21 H19 F N2 O2 S2 |
Smiles: | COCCCN1C(=Nc2c3ccccc3sc2C1=O)SCc1ccccc1F |
Stereo: | ACHIRAL |
logP: | 5.0187 |
logD: | 5.0187 |
logSw: | -4.8199 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 32.858 |
InChI Key: | FJLRAUSQQKYPNU-UHFFFAOYSA-N |