N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-2-oxo-2H-1-benzopyran-3-carboxamide
N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D491-9995 |
| Compound Name: | N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 375.38 |
| Molecular Formula: | C21 H17 N3 O4 |
| Smiles: | [H]N(C(C1=Cc2ccccc2OC1=O)=O)c1ccnn1Cc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8459 |
| logD: | 2.8412 |
| logSw: | -3.5393 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.228 |
| InChI Key: | WZRPGPQEYBAZSU-UHFFFAOYSA-N |