3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4159-0169 |
| Compound Name: | 3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 398.54 |
| Molecular Formula: | C21 H22 N2 O2 S2 |
| Smiles: | CCCCN1C(=Nc2c(C1=O)c1CCCc1s2)SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7692 |
| logD: | 4.7692 |
| logSw: | -4.566 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.457 |
| InChI Key: | FFUMWSDMCXPEAJ-UHFFFAOYSA-N |