2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F396-1230 |
| Compound Name: | 2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 466.62 |
| Molecular Formula: | C24 H26 N4 O2 S2 |
| Smiles: | CC(C)CCN1C(=Nc2c3cccnc3sc2C1=O)SCC(NCc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7333 |
| logD: | 4.7333 |
| logSw: | -4.5165 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.393 |
| InChI Key: | SQQNSUWNGBSNPZ-UHFFFAOYSA-N |