7-tert-butyl-3-(4-methoxyphenyl)-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
7-tert-butyl-3-(4-methoxyphenyl)-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
7-tert-butyl-3-(4-methoxyphenyl)-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4333-3599 |
| Compound Name: | 7-tert-butyl-3-(4-methoxyphenyl)-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 504.71 |
| Molecular Formula: | C29 H32 N2 O2 S2 |
| Smiles: | CC(C)(C)C1CCc2c3C(N(C(=Nc3sc2C1)SCCc1ccccc1)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.579 |
| logD: | 7.579 |
| logSw: | -5.7485 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.526 |
| InChI Key: | MJCOEQCEZJPALS-HXUWFJFHSA-N |