N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride
TL;DR: N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride (CAS 60959-22-0) is a chemical compound with molecular formula C9H17ClN6O and molecular weight 260.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-carbamimidoyl-3-(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dimethylguanidine;hydrochloride
Also Known As: N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride, Imidodicarbonimidic diamide, N,N-dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride, 1-carbamimidoyl-3-(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dimethylguanidine hydrochloride, N-(3,5-Dimethyl-1,2-oxazol-4-yl)-N,N-dimethyltriimidodicarbonic diamide--hydrogen chloride (1/1), RefChem:1087256
| Molecular Formula | C9H17ClN6O |
|---|---|
| Molecular Weight | 260.12 g/mol |
| LogP | 0.90948 |
| Topological Polar Surface Area | 106.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.11523 |
| Heavy Atoms | 17 |
| Complexity | 409.6206 |
Chemical Identifiers
| CAS Number | 60959-22-0 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)N(C)C(=N)N(C)C(=N)N.Cl |
Product Overview
N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride (CAS 60959-22-0), with molecular formula C9H17ClN6O and molecular weight 260.12 g/mol. IUPAC: 1-carbamimidoyl-3-(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dimethylguanidine;hydrochloride.
Chemical Property Profile of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride
Property Insights of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride
The XLogP value of 0.90948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride. The TPSA of 106.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride. Following Lipinski's Rule of Five, N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride?
The CAS number of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride is 60959-22-0.
What is the molecular formula of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride?
The molecular formula of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride is C9H17ClN6O.
What is the molecular weight of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride?
The molecular weight of N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride is 260.12 g/mol.
Where can I buy N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride?
You can request a quote for N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.