2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K263-0453 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)[1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 430.97 |
| Molecular Formula: | C21 H19 Cl N2 O2 S2 |
| Smiles: | COCCCN1C(=Nc2c3ccccc3sc2C1=O)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3875 |
| logD: | 5.3875 |
| logSw: | -5.8551 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.858 |
| InChI Key: | ASGYSFIGQKTKIE-UHFFFAOYSA-N |