ethyl 4-(4-tert-butylphenyl)-2-{2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-tert-butylphenyl)-2-{2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
ethyl 4-(4-tert-butylphenyl)-2-{2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4112-4137 |
| Compound Name: | ethyl 4-(4-tert-butylphenyl)-2-{2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 539.74 |
| Molecular Formula: | C27 H29 N3 O3 S3 |
| Smiles: | CCOC(c1c(csc1NC(CSc1c2c(C)c(C)sc2ncn1)=O)c1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3838 |
| logD: | 7.3716 |
| logSw: | -6.0321 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.439 |
| InChI Key: | PWCBDAACTWJFSI-UHFFFAOYSA-N |