2-[(7-acetyl-3-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-ethyl-N-phenylacetamide
Chemical Structure Depiction of
2-[(7-acetyl-3-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-ethyl-N-phenylacetamide
2-[(7-acetyl-3-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-ethyl-N-phenylacetamide
Compound characteristics
| Compound ID: | G641-0258 |
| Compound Name: | 2-[(7-acetyl-3-benzyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-ethyl-N-phenylacetamide |
| Molecular Weight: | 532.68 |
| Molecular Formula: | C28 H28 N4 O3 S2 |
| Smiles: | CCN(C(CSC1=Nc2c(C(N1Cc1ccccc1)=O)c1CCN(Cc1s2)C(C)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3152 |
| logD: | 4.3152 |
| logSw: | -4.3777 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.814 |
| InChI Key: | VSMGNCVEMRFSLY-UHFFFAOYSA-N |