N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxamide
N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-3672 |
| Compound Name: | N-(4-methyl-2-oxo-2H-1-benzopyran-7-yl)-1-{[4-(propan-2-yl)phenoxy]methyl}-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 417.46 |
| Molecular Formula: | C24 H23 N3 O4 |
| Smiles: | CC(C)c1ccc(cc1)OCn1ccc(C(Nc2ccc3C(C)=CC(=O)Oc3c2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4922 |
| logD: | 4.4909 |
| logSw: | -4.3674 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.1 |
| InChI Key: | LXCAIUBMDCOPHW-UHFFFAOYSA-N |