methyl 4-{2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate
methyl 4-{2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | G300-2256 |
| Compound Name: | methyl 4-{2-[2-(3,4-dimethylphenyl)-8-methoxy-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 513.55 |
| Molecular Formula: | C29 H27 N3 O6 |
| Smiles: | Cc1ccc(cc1C)N1C(C2Cc3cccc(c3OC=2N1CC(Nc1ccc(cc1)C(=O)OC)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4216 |
| logD: | 5.4216 |
| logSw: | -5.4439 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.964 |
| InChI Key: | BXCAEHGCRKBCMG-UHFFFAOYSA-N |