2,2'-二硫代双(5-乙酰氨基苯甲酰胺)
TL;DR: 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) (CAS 171744-41-5) is a chemical compound with molecular formula C18H18N4O4S2 and molecular weight 418.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2'-二硫代双(5-乙酰氨基苯甲酰胺)
5-acetamido-2-[(4-acetamido-2-carbamoylphenyl)disulfanyl]benzamide
Also Known As: Disulfide benzamide analog, 2,2'-Dithiobis-(5-(acetylamino)-benzamide), PD 024886, 2,2'-Disulfanediylbis(5-acetamidobenzamide), 2,2 -Dithiobis[5-(acetylamino)benzamide]
| Molecular Formula | C18H18N4O4S2 |
|---|---|
| Molecular Weight | 418.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 418.07693 |
| Heavy Atoms | 28 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 171744-41-5 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)SSC2=C(C=C(C=C2)NC(=O)C)C(=O)N)C(=O)N |
| InChIKey | DILXJPHGJJMREF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2'-二硫代双(5-乙酰氨基苯甲酰胺) (CAS 171744-41-5), with molecular formula C18H18N4O4S2 and molecular weight 418.08 g/mol. IUPAC: 5-acetamido-2-[(4-acetamido-2-carbamoylphenyl)disulfanyl]benzamide.
Chemical Property Profile of 2,2'-二硫代双(5-乙酰氨基苯甲酰胺)
Property Insights of 2,2'-二硫代双(5-乙酰氨基苯甲酰胺)
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-二硫代双(5-乙酰氨基苯甲酰胺). The TPSA of 195.0 Ų indicates high polarity, suggesting 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) has 4 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 2,2'-二硫代双(5-乙酰氨基苯甲酰胺)?
The CAS number of 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) is 171744-41-5.
What is the molecular formula of 2,2'-二硫代双(5-乙酰氨基苯甲酰胺)?
The molecular formula of 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) is C18H18N4O4S2.
What is the molecular weight of 2,2'-二硫代双(5-乙酰氨基苯甲酰胺)?
The molecular weight of 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) is 418.08 g/mol.
Where can I buy 2,2'-二硫代双(5-乙酰氨基苯甲酰胺)?
You can request a quote for 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-二硫代双(5-乙酰氨基苯甲酰胺)?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-二硫代双(5-乙酰氨基苯甲酰胺) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.