TL;DR: Guanoctine Hydrochloride (CAS 1070-95-7) is a chemical compound with molecular formula C9H22ClN3 and molecular weight 207.15022 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4,4-trimethylpentan-2-yl)guanidine;hydrochloride
Also Known As: Guanoctine HCl, GUANOCTINE HYDROCHLORIDE, starbld0001534, Guanoctine hydrochloride [USAN], Guanoctine (hydrochloride)
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H22ClN3 |
| Molecular Weight | 207.15022 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.15022 Da |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
| SMILES | CC(C)(C)CC(C)(C)N=C(N)N.Cl |
| InChIKey | QRFSLMLESAIOMB-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanoctine Hydrochloride. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanoctine Hydrochloride. Following Lipinski's Rule of Five, Guanoctine Hydrochloride has 3 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Guanoctine Hydrochloride is 1070-95-7.
The molecular formula of Guanoctine Hydrochloride is C9H22ClN3.
The molecular weight of Guanoctine Hydrochloride is 207.15022 g/mol.
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