![2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride structure](/static/products/472/472985-15-2.png)
2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride
TL;DR: 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride (CAS 472985-15-2) is a chemical compound with molecular formula C18H12ClN5O2 and molecular weight 365.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium-3-carbonitrile chloride
Also Known As: 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride, 2-amino-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium-3-carbonitrile chloride
| Molecular Formula | C18H12ClN5O2 |
|---|---|
| Molecular Weight | 365.07 g/mol |
| LogP | -0.03612 |
| Topological Polar Surface Area | 112.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.06796 |
| Heavy Atoms | 26 |
| Complexity | 1192.3735 |
Chemical Identifiers
| CAS Number | 472985-15-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(N2)C=C(C(=[N+]3C4=CC=C(C=C4)[N+](=O)[O-])N)C#N.[Cl-] |
Product Overview
2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride (CAS 472985-15-2), with molecular formula C18H12ClN5O2 and molecular weight 365.07 g/mol. IUPAC: 2-amino-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium-3-carbonitrile chloride.
Chemical Property Profile of 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride
Property Insights of 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride
The XLogP value of -0.03612 indicates that 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride. Following Lipinski's Rule of Five, 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride has 2 hydrogen bond donor(s) and 4 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-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride?
The CAS number of 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride is 472985-15-2.
What is the molecular formula of 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride?
The molecular formula of 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride is C18H12ClN5O2.
What is the molecular weight of 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride?
The molecular weight of 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride is 365.07 g/mol.
Where can I buy 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride?
You can request a quote for 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-3-cyano-1-(4-nitrophenyl)-5H-pyrido[3,2-b]indol-1-ium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.