![2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline structure](/static/products/5165/51657-41-1.webp)
2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline
TL;DR: 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline (CAS 51657-41-1) is a chemical compound with molecular formula C12H10N4O4S2 and molecular weight 338.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-amino-4-nitrophenyl)disulfanyl]-5-nitroaniline
Also Known As: Benzenamine, 2,2'-dithiobis[5-nitro-, 2-[(2-amino-4-nitrophenyl)disulfanyl]-5-nitroaniline, 2,2'-Disulfanediylbis(5-nitroaniline), 6,6'-disulfanediylbis(3-nitroaniline), 2,2'-Diamino-4,4'-dinitrodiphenyl disulfide
| Molecular Formula | C12H10N4O4S2 |
|---|---|
| Molecular Weight | 338.01 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 194.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.01434 |
| Heavy Atoms | 22 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 51657-41-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])N)SSC2=C(C=C(C=C2)[N+](=O)[O-])N |
| InChIKey | IPFHDGFNMJCLQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline (CAS 51657-41-1), with molecular formula C12H10N4O4S2 and molecular weight 338.01 g/mol. IUPAC: 2-[(2-amino-4-nitrophenyl)disulfanyl]-5-nitroaniline.
Chemical Property Profile of 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline
Property Insights of 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline. The TPSA of 194.0 Ų indicates high polarity, suggesting 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline has 2 hydrogen bond donor(s) and 8 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-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline?
The CAS number of 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline is 51657-41-1.
What is the molecular formula of 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline?
The molecular formula of 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline is C12H10N4O4S2.
What is the molecular weight of 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline?
The molecular weight of 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline is 338.01 g/mol.
Where can I buy 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline?
You can request a quote for 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Amino-4-nitrophenyl)disulfanyl]-5-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.