Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride
TL;DR: Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride (CAS 60959-21-9) is a chemical compound with molecular formula C11H21ClN6O and molecular weight 288.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-1-carbamimidoyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)guanidine;hydrochloride
Also Known As: Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride, N-Butyl-N'-(3,5-dimethyl-4-isoxazolyl)imidodicarbonimidic diamide monohydrochloride, 1-butyl-1-carbamimidoyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)guanidine hydrochloride, N-Butyl-N''-(3,5-dimethyl-1,2-oxazol-4-yl)triimidodicarbonic diamide--hydrogen chloride (1/1), RefChem:349013
| Molecular Formula | C11H21ClN6O |
|---|---|
| Molecular Weight | 288.15 g/mol |
| LogP | 1.65501 |
| Topological Polar Surface Area | 117.52 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.14655 |
| Heavy Atoms | 19 |
| Complexity | 436.53793 |
Chemical Identifiers
| CAS Number | 60959-21-9 |
|---|---|
| SMILES | CCCCN(C(=N)N)C(=NC1=C(ON=C1C)C)N.Cl |
Product Overview
Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride (CAS 60959-21-9), with molecular formula C11H21ClN6O and molecular weight 288.15 g/mol. IUPAC: 1-butyl-1-carbamimidoyl-2-(3,5-dimethyl-1,2-oxazol-4-yl)guanidine;hydrochloride.
Chemical Property Profile of Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride
Property Insights of Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride
The XLogP value of 1.65501 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride. The TPSA of 117.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride. Following Lipinski's Rule of Five, Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, 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 Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride?
The CAS number of Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride is 60959-21-9.
What is the molecular formula of Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride?
The molecular formula of Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride is C11H21ClN6O.
What is the molecular weight of Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride?
The molecular weight of Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride is 288.15 g/mol.
Where can I buy Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride?
You can request a quote for Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Imidodicarbonimidic diamide, N-butyl-N'-(3,5-dimethyl-4-isoxazolyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.