ethyl {3-methyl-5-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-1H-pyrazol-1-yl}acetate
Chemical Structure Depiction of
ethyl {3-methyl-5-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-1H-pyrazol-1-yl}acetate
ethyl {3-methyl-5-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-1H-pyrazol-1-yl}acetate
Compound characteristics
| Compound ID: | 8018-1117 |
| Compound Name: | ethyl {3-methyl-5-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]-1H-pyrazol-1-yl}acetate |
| Molecular Weight: | 355.35 |
| Molecular Formula: | C18 H17 N3 O5 |
| Smiles: | CCOC(Cn1c(cc(C)n1)NC(C1=Cc2ccccc2OC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6441 |
| logD: | 1.5588 |
| logSw: | -2.3892 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.787 |
| InChI Key: | HTMQMHDQFLWOEL-UHFFFAOYSA-N |