Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride
TL;DR: Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride (CAS 67292-79-9) is a chemical compound with molecular formula C18H15Cl2N7O and molecular weight 415.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-di(pyridin-1-ium-1-yl)-1,2,4-triazol-1-yl]pyridine-4-carboxamide dichloride
Also Known As: N-(3,5-Di-4-pyridyl-s-triazol-4-yl)isonicotinamide, dihydrochloride, 1H-1,2,4-Triazole, 3,5-bis(4-pyridyl)-1-isonicotinamido-, dihydrochloride, ISONICOTINAMIDE, N-(3,5-BIS(4-PYRIDYL)-1H-1,2,4-TRIAZOLYL)-, DIHYDROCHLORIDE, 4-Pyridinecarboxamide, N-(3,5-di-4-pyridinyl-1H-1,2,4-triazol-1-yl)-, dihydrochloride, N-[3,5-di(pyridin-1-ium-1-yl)-1,2,4-triazol-1-yl]pyridine-4-carboxamide dichloride
| Molecular Formula | C18H15Cl2N7O |
|---|---|
| Molecular Weight | 415.07 g/mol |
| LogP | -5.38 |
| Topological Polar Surface Area | 80.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.0715 |
| Heavy Atoms | 28 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 67292-79-9 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)C2=NN(C(=N2)[N+]3=CC=CC=C3)NC(=O)C4=CC=NC=C4.[Cl-].[Cl-] |
| InChIKey | OXSUXZDHVYPJLU-UHFFFAOYSA-M |
Product Overview
Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride (CAS 67292-79-9), with molecular formula C18H15Cl2N7O and molecular weight 415.07 g/mol. IUPAC: N-[3,5-di(pyridin-1-ium-1-yl)-1,2,4-triazol-1-yl]pyridine-4-carboxamide dichloride.
Chemical Property Profile of Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride
Property Insights of Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride
The XLogP value of -5.38 indicates that Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride. Following Lipinski's Rule of Five, Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride has 1 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 Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride?
The CAS number of Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride is 67292-79-9.
What is the molecular formula of Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride?
The molecular formula of Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride is C18H15Cl2N7O.
What is the molecular weight of Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride?
The molecular weight of Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride is 415.07 g/mol.
Where can I buy Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride?
You can request a quote for Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Isonicotinamide, N-(3,5-bis(4-pyridyl)-1H-1,2,4-triazolyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.