RefChem:330608
TL;DR: RefChem:330608 (CAS 62287-32-5) is a chemical compound with molecular formula C16H25NO8S2 and molecular weight 423.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium 4-[[2-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxy]-4-oxobutanoate
Also Known As: Butanedioic acid, mono(2-(2-(1-methylethoxy)-1-((1-methylethoxy)carbonyl)-2-oxoethylidene)-1,3-dithiolan-4-yl) ester, ammonium salt, azanium 4-[[2-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxy]-4-oxobutanoate, Azanium 4-[[2-[bis(propan-2-yloxycarbonyl)methylidene]-1,3-dithiolan-4-yl]oxy]-4-oxo-butanoate, RefChem:330608
| Molecular Formula | C16H25NO8S2 |
|---|---|
| Molecular Weight | 423.10 g/mol |
| LogP | 1.3568 |
| Topological Polar Surface Area | 155.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 423.10217 |
| Heavy Atoms | 27 |
| Complexity | 579.2277 |
Chemical Identifiers
| CAS Number | 62287-32-5 |
|---|---|
| SMILES | CC(C)OC(=O)C(=C1SCC(S1)OC(=O)CCC(=O)[O-])C(=O)OC(C)C.[NH4+] |
Product Overview
RefChem:330608 (CAS 62287-32-5), with molecular formula C16H25NO8S2 and molecular weight 423.10 g/mol. IUPAC: azanium 4-[[2-[1,3-dioxo-1,3-di(propan-2-yloxy)propan-2-ylidene]-1,3-dithiolan-4-yl]oxy]-4-oxobutanoate.
Chemical Property Profile of RefChem:330608
Property Insights of RefChem:330608
The XLogP value of 1.3568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:330608. The TPSA of 155.53 Ų indicates high polarity, suggesting RefChem:330608 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:330608 has 1 hydrogen bond donor(s) and 10 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:330608?
The CAS number of RefChem:330608 is 62287-32-5.
What is the molecular formula of RefChem:330608?
The molecular formula of RefChem:330608 is C16H25NO8S2.
What is the molecular weight of RefChem:330608?
The molecular weight of RefChem:330608 is 423.10 g/mol.
Where can I buy RefChem:330608?
You can request a quote for RefChem:330608 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:330608?
Yes, KEHONG BIO provides custom synthesis services for RefChem:330608 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.