3-[7-(3-fluorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[7-(3-fluorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
3-[7-(3-fluorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | F656-0288 |
| Compound Name: | 3-[7-(3-fluorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}propanamide |
| Molecular Weight: | 464.56 |
| Molecular Formula: | C25 H25 F N4 O2 S |
| Smiles: | Cc1c2C(N(CCC(NCc3ccc(cc3)SC)=O)C=Nc2n(c2cccc(c2)F)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8923 |
| logD: | 3.8923 |
| logSw: | -4.2013 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.115 |
| InChI Key: | NGRZLYGXZWDDNS-UHFFFAOYSA-N |