![3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide structure](/static/products/7256/72569-76-7.webp)
3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide
TL;DR: 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide (CAS 72569-76-7) is a chemical compound with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide
Also Known As: 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide, 3,5-Dimethyl-N-[(1-oxo-1lambda~5~-pyridin-3-yl)methyl]benzamide
| Molecular Formula | C15H16N2O2 |
|---|---|
| Molecular Weight | 256.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.1212 |
| Heavy Atoms | 19 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 72569-76-7 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)C(=O)NCC2=C[N+](=CC=C2)[O-])C |
| InChIKey | POPNRBUKXYNMNI-UHFFFAOYSA-N |
Product Overview
3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide (CAS 72569-76-7), with molecular formula C15H16N2O2 and molecular weight 256.12 g/mol. IUPAC: 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide.
Chemical Property Profile of 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide
Property Insights of 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide. With a topological polar surface area (TPSA) of 54.6 Ų, 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide has 1 hydrogen bond donor(s) and 2 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 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide?
The CAS number of 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide is 72569-76-7.
What is the molecular formula of 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide?
The molecular formula of 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide is C15H16N2O2.
What is the molecular weight of 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide?
The molecular weight of 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide is 256.12 g/mol.
Where can I buy 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide?
You can request a quote for 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-dimethyl-N-[(1-oxidopyridin-1-ium-3-yl)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.