ethyl 6-methyl-3-{2-[(7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 6-methyl-3-{2-[(7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
ethyl 6-methyl-3-{2-[(7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 4789-4010 |
| Compound Name: | ethyl 6-methyl-3-{2-[(7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 515.72 |
| Molecular Formula: | C25 H29 N3 O3 S3 |
| Smiles: | CCOC(c1c(c2CCC(C)Cc2s1)NC(CSc1c2c3CCC(C)Cc3sc2ncn1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.253 |
| logD: | 6.1779 |
| logSw: | -5.6508 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.38 |
| InChI Key: | UHEJKJFXILQIRU-UHFFFAOYSA-N |