methyl [(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
methyl [(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 2969-0003 |
| Compound Name: | methyl [(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 392.54 |
| Molecular Formula: | C19 H24 N2 O3 S2 |
| Smiles: | COC(CSC1=Nc2c(C(N1C1CCCCC1)=O)c1CCCCc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1501 |
| logD: | 4.1501 |
| logSw: | -4.2204 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.666 |
| InChI Key: | QAXNVHRPVUPQCZ-UHFFFAOYSA-N |