2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | G300-2422 |
| Compound Name: | 2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 506.02 |
| Molecular Formula: | C27 H24 Cl N3 O3 S |
| Smiles: | CCc1ccc(cc1)N1C(C2Cc3cc(ccc3OC=2N1CC(Nc1cccc(c1)SC)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2907 |
| logD: | 6.2907 |
| logSw: | -6.1421 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.476 |
| InChI Key: | RGDWFRAQVQACME-UHFFFAOYSA-N |