2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)
TL;DR: 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) (CAS 96835-54-0) is a chemical compound with molecular formula C22H28N2O4S2 and molecular weight 448.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-hydroxybutan-2-yl)-2-[[2-(1-hydroxybutan-2-ylcarbamoyl)phenyl]disulfanyl]benzamide
Also Known As: Benzamide der., 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide), 2,2'-Dithiobis[N-(1-hydroxyethylpropyl)benzamide], 2,2'-Disulfanediylbis[N-(1-hydroxybutan-2-yl)benzene-1-carboximidic acid], N-(1-hydroxybutan-2-yl)-2-[[2-(1-hydroxybutan-2-ylcarbamoyl)phenyl]disulfanyl]benzamide
| Molecular Formula | C22H28N2O4S2 |
|---|---|
| Molecular Weight | 448.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 448.14905 |
| Heavy Atoms | 30 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 96835-54-0 |
|---|---|
| SMILES | CCC(CO)NC(=O)C1=CC=CC=C1SSC2=CC=CC=C2C(=O)NC(CC)CO |
| InChIKey | YYWTYTCHSRLVJN-UHFFFAOYSA-N |
Product Overview
2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) (CAS 96835-54-0), with molecular formula C22H28N2O4S2 and molecular weight 448.15 g/mol. IUPAC: N-(1-hydroxybutan-2-yl)-2-[[2-(1-hydroxybutan-2-ylcarbamoyl)phenyl]disulfanyl]benzamide.
Chemical Property Profile of 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)
Property Insights of 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)
The XLogP value of 3.1 indicates that 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) 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'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)?
The CAS number of 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) is 96835-54-0.
What is the molecular formula of 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)?
The molecular formula of 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) is C22H28N2O4S2.
What is the molecular weight of 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)?
The molecular weight of 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) is 448.15 g/mol.
Where can I buy 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)?
You can request a quote for 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide)?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-Dithiobis(N-(1-hydroxyethylpropyl)benzamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.