ethyl 4-(3,4-dimethylphenyl)-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(3,4-dimethylphenyl)-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
ethyl 4-(3,4-dimethylphenyl)-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4112-3822 |
| Compound Name: | ethyl 4-(3,4-dimethylphenyl)-2-{2-[(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 537.72 |
| Molecular Formula: | C27 H27 N3 O3 S3 |
| Smiles: | CCOC(c1c(csc1NC(CSc1c2c3CCCCc3sc2ncn1)=O)c1ccc(C)c(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9711 |
| logD: | 6.9589 |
| logSw: | -5.967 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.359 |
| InChI Key: | RLDRMKWBSBBPGE-UHFFFAOYSA-N |