ethyl 4-{2-[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
ethyl 4-{2-[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 5400-0905 |
| Compound Name: | ethyl 4-{2-[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C21 H22 N4 O3 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1nc(c2c3CCCCc3sc2n1)N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8419 |
| logD: | 4.8418 |
| logSw: | -4.8734 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.885 |
| InChI Key: | DEBBIUWABDVSGL-UHFFFAOYSA-N |