N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C434-0067 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-oxo[1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)acetamide |
| Molecular Weight: | 407.42 |
| Molecular Formula: | C22 H21 N3 O5 |
| Smiles: | COc1ccc(CCNC(Cn2c3c4ccccc4OC(c3cn2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.6771 |
| logD: | 1.6771 |
| logSw: | -2.5881 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.032 |
| InChI Key: | GXAIZMRTMLQIOG-UHFFFAOYSA-N |