N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide
TL;DR: N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide (CAS 548451-53-2) is a chemical compound with molecular formula C20H18N4O2 and molecular weight 346.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[(pyridine-4-carbonylamino)methyl]phenyl]methyl]pyridine-4-carboxamide
Also Known As: N,N'-(1,4-PHENYLENEBIS(METHYLENE))DIISONICOTINAMIDE, J2.722.467I, 1,4-Bis(4-pyridinylcarbonylaminomethyl)benzene, N,N -(1,4-Phenylenebismethylene)bis(pyridine-4-carboxamide), N,N'-(benzene-1,4-diyldimethanediyl)dipyridine-4-carboxamide
| Molecular Formula | C20H18N4O2 |
|---|---|
| Molecular Weight | 346.14 g/mol |
| LogP | 2.3366 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 346.14297 |
| Heavy Atoms | 26 |
| Complexity | 790.83264 |
Chemical Identifiers
| CAS Number | 548451-53-2 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC(=O)C2=CC=NC=C2)CNC(=O)C3=CC=NC=C3 |
Product Overview
N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide (CAS 548451-53-2), with molecular formula C20H18N4O2 and molecular weight 346.14 g/mol. IUPAC: N-[[4-[(pyridine-4-carbonylamino)methyl]phenyl]methyl]pyridine-4-carboxamide.
Chemical Property Profile of N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide
Property Insights of N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide
The XLogP value of 2.3366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide. Following Lipinski's Rule of Five, N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide 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 N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide?
The CAS number of N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide is 548451-53-2.
What is the molecular formula of N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide?
The molecular formula of N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide is C20H18N4O2.
What is the molecular weight of N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide?
The molecular weight of N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide is 346.14 g/mol.
Where can I buy N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide?
You can request a quote for N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N,N'-(1,4-Phenylenebis(methylene))diisonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.