TL;DR: 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide (CAS 120445-82-1) is a chemical compound with molecular formula C9H10FN3O and molecular weight 195.0808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-(4-fluorophenyl)ethylideneamino]urea
Also Known As: 4-fluoroacetophenone semicarbazone, {[1-(4-fluorophenyl)ethylidene]amino}urea, [1-(4-fluorophenyl)ethylideneamino]urea, 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide, [1-(4-FLUOROPHENYL)ETHYLIDENE]AMINOUREA
| Molecular Formula | C9H10FN3O |
| Molecular Weight | 195.0808 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.0808 Da |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
| SMILES | CC(=NNC(=O)N)C1=CC=C(C=C1)F |
| InChIKey | ZYYTYSQJWLDRSR-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide. Following Lipinski's Rule of Five, 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide is 120445-82-1.
The molecular formula of 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide is C9H10FN3O.
The molecular weight of 2-(1-(4-Fluorophenyl)ethylidene)hydrazine-1-carboxamide is 195.0808 g/mol.
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