3-(4-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-(4-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4333-3645 |
| Compound Name: | 3-(4-methoxyphenyl)-2-[(3-methylbutyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 414.59 |
| Molecular Formula: | C22 H26 N2 O2 S2 |
| Smiles: | CC(C)CCSC1=Nc2c(C(N1c1ccc(cc1)OC)=O)c1CCCCc1s2 |
| Stereo: | ACHIRAL |
| logP: | 5.7025 |
| logD: | 5.7025 |
| logSw: | -5.4861 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.798 |
| InChI Key: | KVRNIXPEIGZJAK-UHFFFAOYSA-N |