CAS 6781-25-5 - C21H17N6O2+
TL;DR: CAS 6781-25-5 - C21H17N6O2+ (CAS 6781-25-5) is a chemical compound with molecular formula C21H17N6O2+ and molecular weight 385.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-oxo-3-phenyl-5-pyridin-1-ium-1-yl-1H-imidazol-4-yl)methylideneamino]pyridine-4-carboxamide
| Molecular Formula | C21H17N6O2+ |
|---|---|
| Molecular Weight | 385.14 g/mol |
| LogP | 1.6012 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.1413 |
| Heavy Atoms | 29 |
| Complexity | 1198.4221 |
Chemical Identifiers
| CAS Number | 6781-25-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=C(NC2=O)[N+]3=CC=CC=C3)C=NNC(=O)C4=CC=NC=C4 |
Product Overview
CAS 6781-25-5 - C21H17N6O2+ (CAS 6781-25-5), with molecular formula C21H17N6O2+ and molecular weight 385.14 g/mol. IUPAC: N-[(2-oxo-3-phenyl-5-pyridin-1-ium-1-yl-1H-imidazol-4-yl)methylideneamino]pyridine-4-carboxamide.
Chemical Property Profile of CAS 6781-25-5 - C21H17N6O2+
Property Insights of CAS 6781-25-5 - C21H17N6O2+
The XLogP value of 1.6012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CAS 6781-25-5 - C21H17N6O2+. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 6781-25-5 - C21H17N6O2+. Following Lipinski's Rule of Five, CAS 6781-25-5 - C21H17N6O2+ 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 CAS 6781-25-5 - C21H17N6O2+?
The CAS number of CAS 6781-25-5 - C21H17N6O2+ is 6781-25-5.
What is the molecular formula of CAS 6781-25-5 - C21H17N6O2+?
The molecular formula of CAS 6781-25-5 - C21H17N6O2+ is C21H17N6O2+.
What is the molecular weight of CAS 6781-25-5 - C21H17N6O2+?
The molecular weight of CAS 6781-25-5 - C21H17N6O2+ is 385.14 g/mol.
Where can I buy CAS 6781-25-5 - C21H17N6O2+?
You can request a quote for CAS 6781-25-5 - C21H17N6O2+ directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 6781-25-5 - C21H17N6O2+?
Yes, KEHONG BIO provides custom synthesis services for CAS 6781-25-5 - C21H17N6O2+ and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.