TL;DR: 1-(2,4-Difluorophenyl)biguanide (CAS 159733-97-8) is a chemical compound with molecular formula C8H9F2N5 and molecular weight 213.0826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(diaminomethylidene)-2-(2,4-difluorophenyl)guanidine
Also Known As: Maybridge1_006929, 1-(2,4-Difluorophenyl)biguanide, N-(2,4-difluorophenyl)dicarbonimido/ic diamide/imido, 1-(diaminomethylidene)-2-(2,4-difluorophenyl)guanidine, 1-carbamimidamido-N-(2,4-difluorophenyl)methanimidamide
| Molecular Formula | C8H9F2N5 |
| Molecular Weight | 213.0826 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.0826 Da |
| Heavy Atoms | 15 |
| Complexity | 274.0 |
| SMILES | C1=CC(=C(C=C1F)F)N=C(N)N=C(N)N |
| InChIKey | AKYXEMYENQTFQJ-UHFFFAOYSA-N |
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Difluorophenyl)biguanide. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Difluorophenyl)biguanide. Following Lipinski's Rule of Five, 1-(2,4-Difluorophenyl)biguanide has 3 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 1-(2,4-Difluorophenyl)biguanide is 159733-97-8.
The molecular formula of 1-(2,4-Difluorophenyl)biguanide is C8H9F2N5.
The molecular weight of 1-(2,4-Difluorophenyl)biguanide is 213.0826 g/mol.
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