RefChem:1092110
TL;DR: RefChem:1092110 (CAS 23765-90-4) is a chemical compound with molecular formula C15H20ClN5O3S and molecular weight 385.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(tert-butylcarbamoyl)-4-oxidoquinoxalin-4-ium-2-yl]methyl N'-hydroxycarbamimidothioate;hydrochloride
Also Known As: Pseudourea, 2-((3-(tert-butylcarbamoyl)-2-quinoxalinyl)methyl)-2-thio-, 1,4-dioxide, monohydrochloride, N-tert-Butyl-3-(((N-hydroxycarbamimidoyl)sulfanyl)methyl)-1-oxo-1lambda~5~-quinoxaline-2-carboximidic acid--hydrogen chloride (1/1), RefChem:1092110
| Molecular Formula | C15H20ClN5O3S |
|---|---|
| Molecular Weight | 385.10 g/mol |
| LogP | 1.7554 |
| Topological Polar Surface Area | 127.54 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.09753 |
| Heavy Atoms | 25 |
| Complexity | 807.5888 |
Chemical Identifiers
| CAS Number | 23765-90-4 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=[N+](C2=CC=CC=C2N=C1CS/C(=N/O)/N)[O-].Cl |
Product Overview
RefChem:1092110 (CAS 23765-90-4), with molecular formula C15H20ClN5O3S and molecular weight 385.10 g/mol. IUPAC: [3-(tert-butylcarbamoyl)-4-oxidoquinoxalin-4-ium-2-yl]methyl N'-hydroxycarbamimidothioate;hydrochloride.
Chemical Property Profile of RefChem:1092110
Property Insights of RefChem:1092110
The XLogP value of 1.7554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1092110. The TPSA of 127.54 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1092110. Following Lipinski's Rule of Five, RefChem:1092110 has 3 hydrogen bond donor(s) and 6 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 RefChem:1092110?
The CAS number of RefChem:1092110 is 23765-90-4.
What is the molecular formula of RefChem:1092110?
The molecular formula of RefChem:1092110 is C15H20ClN5O3S.
What is the molecular weight of RefChem:1092110?
The molecular weight of RefChem:1092110 is 385.10 g/mol.
Where can I buy RefChem:1092110?
You can request a quote for RefChem:1092110 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1092110?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1092110 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.