TL;DR: Butamidine (CAS 124076-61-5) is a chemical compound with molecular formula C18H23ClN4O2 and molecular weight 362.15094 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[4-(4-carbamimidoylphenoxy)butoxy]benzenecarboximidamide;hydrochloride
Also Known As: Butamidine, 1,4-Bis(4-amidinophenoxy)butane, 4-[4-(4-carbamimidoylphenoxy)butoxy]benzenecarboximidamide;hydrochloride, Benzenecarboximidamide, 4,4'-(1,4-butanediylbis(oxy))bis-, hydrochloride, 4-[4-(4-carbamimidoylphenoxy)butoxy]benzenecarboximidamide hydrochloride
| Molecular Formula | C18H23ClN4O2 |
| Molecular Weight | 362.15094 g/mol |
| XLogP | 2.91454 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 362.15094 Da |
| Heavy Atoms | 25 |
| Complexity | 362.0 |
| SMILES | C1=CC(=CC=C1C(=N)N)OCCCCOC2=CC=C(C=C2)C(=N)N.Cl |
| InChIKey | PGCCWKNTLABRMZ-UHFFFAOYSA-N |
The XLogP value of 2.91454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butamidine. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butamidine. Following Lipinski's Rule of Five, Butamidine has 5 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Butamidine is 124076-61-5.
The molecular formula of Butamidine is C18H23ClN4O2.
The molecular weight of Butamidine is 362.15094 g/mol.
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