2-({7-acetyl-4-oxo-3-[(oxolan-2-yl)methyl]-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
Chemical Structure Depiction of
2-({7-acetyl-4-oxo-3-[(oxolan-2-yl)methyl]-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
2-({7-acetyl-4-oxo-3-[(oxolan-2-yl)methyl]-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | G641-0398 |
| Compound Name: | 2-({7-acetyl-4-oxo-3-[(oxolan-2-yl)methyl]-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl}sulfanyl)-N-(4-ethylphenyl)acetamide |
| Molecular Weight: | 526.68 |
| Molecular Formula: | C26 H30 N4 O4 S2 |
| Smiles: | CCc1ccc(cc1)NC(CSC1=Nc2c(C(N1CC1CCCO1)=O)c1CCN(Cc1s2)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.354 |
| logD: | 3.354 |
| logSw: | -3.6433 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.527 |
| InChI Key: | ASDSZWRZKXNUQN-LJQANCHMSA-N |