2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G300-2278 |
| Compound Name: | 2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 501.6 |
| Molecular Formula: | C28 H27 N3 O4 S |
| Smiles: | Cc1ccc(cc1C)N1C(C2Cc3cccc(c3OC=2N1CC(Nc1cccc(c1)SC)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7918 |
| logD: | 5.7918 |
| logSw: | -5.4143 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.791 |
| InChI Key: | REEFBTDEYUFGON-UHFFFAOYSA-N |