2-(3-chloro-5-methoxy-4-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}phenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(3-chloro-5-methoxy-4-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}phenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-(3-chloro-5-methoxy-4-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}phenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3810-1408 |
| Compound Name: | 2-(3-chloro-5-methoxy-4-{2-[2-(3-methylphenoxy)ethoxy]ethoxy}phenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 541.07 |
| Molecular Formula: | C28 H29 Cl N2 O5 S |
| Smiles: | Cc1cccc(c1)OCCOCCOc1c(cc(cc1[Cl])C1NC(c2c3CCCCc3sc2N=1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.7699 |
| logD: | 5.722 |
| logSw: | -6.1261 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.353 |
| InChI Key: | MFJFIAFGORFZAN-UHFFFAOYSA-N |