methyl 4-phenyl-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4-phenyl-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
methyl 4-phenyl-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3993-2538 |
| Compound Name: | methyl 4-phenyl-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C24 H21 N3 O3 S3 |
| Smiles: | COC(c1c(csc1NC(CSc1c2c3CCCCc3sc2ncn1)=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5596 |
| logD: | 5.5474 |
| logSw: | -5.7826 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.78 |
| InChI Key: | QXWYZWCPTUVGJC-UHFFFAOYSA-N |