N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamide
Compound characteristics
| Compound ID: | G300-2447 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamide |
| Molecular Weight: | 517.97 |
| Molecular Formula: | C28 H24 Cl N3 O5 |
| Smiles: | CCc1ccc(cc1)N1C(C2Cc3cc(ccc3OC=2N1CC(NCc1ccc2c(c1)OCO2)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3206 |
| logD: | 5.3206 |
| logSw: | -5.8222 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.913 |
| InChI Key: | QYXPJXXYBQCBSH-UHFFFAOYSA-N |