TL;DR: N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide (CAS 1039008-78-0) is a chemical compound with molecular formula C16H14F3N5O4 and molecular weight 397.0998 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide
Also Known As: N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide, N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-3-(trifluoromethyl)-1H-pyrazole-5-carbohydrazide, N'-[1-(4-METHOXYPHENYL)-2,5-DIOXOTETRAHYDRO-1H-PYRROL-3-YL]-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-CARBOHYDRAZIDE, N-{[1-(4-methoxyphenyl)-2,5-dioxoazolidin-3-yl]amino}[3-(trifluoromethyl)pyraz ol-5-yl]carboxamide
| Molecular Formula | C16H14F3N5O4 |
| Molecular Weight | 397.0998 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.0998 Da |
| Heavy Atoms | 28 |
| Complexity | 624.0 |
| SMILES | COC1=CC=C(C=C1)N2C(=O)CC(C2=O)NNC(=O)C3=NNC(=C3)C(F)(F)F |
| InChIKey | FQRWJOFTIRDBDF-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide. Following Lipinski's Rule of Five, N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide is 1039008-78-0.
The molecular formula of N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide is C16H14F3N5O4.
The molecular weight of N'-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carbohydrazide is 397.0998 g/mol.
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