ethyl 2-{2-[(4-oxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[(4-oxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
ethyl 2-{2-[(4-oxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8016-9263 |
| Compound Name: | ethyl 2-{2-[(4-oxo-1,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 443.54 |
| Molecular Formula: | C21 H21 N3 O4 S2 |
| Smiles: | CCOC(c1ccccc1NC(CSC1Nc2c(C(N=1)=O)c1CCCCc1s2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6753 |
| logD: | 1.119 |
| logSw: | -4.0889 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.529 |
| InChI Key: | UZVYFXHISHHWFO-UHFFFAOYSA-N |