3-{[(7-acetyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-methoxybenzaldehyde
Chemical Structure Depiction of
3-{[(7-acetyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-methoxybenzaldehyde
3-{[(7-acetyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-methoxybenzaldehyde
Compound characteristics
| Compound ID: | G641-0058 |
| Compound Name: | 3-{[(7-acetyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-methoxybenzaldehyde |
| Molecular Weight: | 505.61 |
| Molecular Formula: | C26 H23 N3 O4 S2 |
| Smiles: | CC(N1CCc2c3C(N(C(=Nc3sc2C1)SCc1cc(C=O)ccc1OC)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5952 |
| logD: | 3.5952 |
| logSw: | -3.9403 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.901 |
| InChI Key: | YIBWQPPHDUADMO-UHFFFAOYSA-N |