benzyl [3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
Chemical Structure Depiction of
benzyl [3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
benzyl [3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetate
Compound characteristics
| Compound ID: | C258-0313 |
| Compound Name: | benzyl [3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]acetate |
| Molecular Weight: | 476.55 |
| Molecular Formula: | C26 H24 N2 O5 S |
| Smiles: | COc1cccc(c1)N1C(c2c3CCCCc3sc2N(CC(=O)OCc2ccccc2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9217 |
| logD: | 4.9217 |
| logSw: | -5.0213 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.106 |
| InChI Key: | HICZFEWWTMUGKF-UHFFFAOYSA-N |