dimethyl 5-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | E146-1306 |
| Compound Name: | dimethyl 5-[(1-methyl-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carbonyl)amino]benzene-1,3-dicarboxylate |
| Molecular Weight: | 421.41 |
| Molecular Formula: | C22 H19 N3 O6 |
| Smiles: | Cn1c2c3ccccc3OCc2c(C(Nc2cc(cc(c2)C(=O)OC)C(=O)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3794 |
| logD: | 3.3791 |
| logSw: | -3.9447 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.45 |
| InChI Key: | YLFVWBWVVCSWOW-UHFFFAOYSA-N |