ethyl 4-{2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate
ethyl 4-{2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | G300-2402 |
| Compound Name: | ethyl 4-{2-[6-chloro-2-(4-ethylphenyl)-3-oxo-2,3-dihydro[1]benzopyrano[2,3-c]pyrazol-1(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 532 |
| Molecular Formula: | C29 H26 Cl N3 O5 |
| Smiles: | CCc1ccc(cc1)N1C(C2Cc3cc(ccc3OC=2N1CC(Nc1ccc(cc1)C(=O)OCC)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4311 |
| logD: | 6.4311 |
| logSw: | -6.3481 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.229 |
| InChI Key: | JJVGZJGZLDQOAH-UHFFFAOYSA-N |