Cystine-bis-4-nitroanilide
TL;DR: Cystine-bis-4-nitroanilide (CAS 34199-07-0) is a chemical compound with molecular formula C18H20N6O6S2 and molecular weight 480.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3-[[2-amino-3-(4-nitroanilino)-3-oxopropyl]disulfanyl]-N-(4-nitrophenyl)propanamide
Also Known As: (H-Cys-pNA)2, (H-Cys-pNA), Cystine-bis-4-nitroanilide, n,n'-bis(4-nitrophenyl)cystinamide, cystine-bis-p-nitroanilide
| Molecular Formula | C18H20N6O6S2 |
|---|---|
| Molecular Weight | 480.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 252.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 480.08856 |
| Heavy Atoms | 32 |
| Complexity | 603.0 |
Chemical Identifiers
| CAS Number | 34199-07-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C(CSSCC(C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N)N)[N+](=O)[O-] |
| InChIKey | UDNQCHDHUMEZRM-UHFFFAOYSA-N |
Product Overview
Cystine-bis-4-nitroanilide (CAS 34199-07-0), with molecular formula C18H20N6O6S2 and molecular weight 480.09 g/mol. IUPAC: 2-amino-3-[[2-amino-3-(4-nitroanilino)-3-oxopropyl]disulfanyl]-N-(4-nitrophenyl)propanamide.
Chemical Property Profile of Cystine-bis-4-nitroanilide
Property Insights of Cystine-bis-4-nitroanilide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cystine-bis-4-nitroanilide. The TPSA of 252.0 Ų indicates high polarity, suggesting Cystine-bis-4-nitroanilide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cystine-bis-4-nitroanilide has 4 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 Cystine-bis-4-nitroanilide?
The CAS number of Cystine-bis-4-nitroanilide is 34199-07-0.
What is the molecular formula of Cystine-bis-4-nitroanilide?
The molecular formula of Cystine-bis-4-nitroanilide is C18H20N6O6S2.
What is the molecular weight of Cystine-bis-4-nitroanilide?
The molecular weight of Cystine-bis-4-nitroanilide is 480.09 g/mol.
Where can I buy Cystine-bis-4-nitroanilide?
You can request a quote for Cystine-bis-4-nitroanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cystine-bis-4-nitroanilide?
Yes, KEHONG BIO provides custom synthesis services for Cystine-bis-4-nitroanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.