![1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium structure](/static/products/3935/393540-36-8.webp)
1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium
TL;DR: 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium (CAS 393540-36-8) is a chemical compound with molecular formula C21H18N3O3+ and molecular weight 360.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-benzamidophenyl)-2-oxoethyl]pyridin-1-ium-3-carboxamide
Also Known As: 1-[2-(4-BENZAMIDOPHENYL)-2-OXOETHYL]-3-CARBAMOYLPYRIDIN-1-IUM, 1-[2-(4-benzamidophenyl)-2-oxoethyl]pyridin-1-ium-3-carboxamide, 3-(aminocarbonyl)-1-{2-[4-(benzoylamino)phenyl]-2-oxoethyl}pyridinium, Pyridinium, 3-(aminocarbonyl)-1-[2-[4-(benzoylamino)phenyl]-2-oxoethyl]-
| Molecular Formula | C21H18N3O3+ |
|---|---|
| Molecular Weight | 360.13 g/mol |
| LogP | 2.2082 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.13483 |
| Heavy Atoms | 27 |
| Complexity | 983.06836 |
Chemical Identifiers
| CAS Number | 393540-36-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)C[N+]3=CC=CC(=C3)C(=O)N |
Product Overview
1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium (CAS 393540-36-8), with molecular formula C21H18N3O3+ and molecular weight 360.13 g/mol. IUPAC: 1-[2-(4-benzamidophenyl)-2-oxoethyl]pyridin-1-ium-3-carboxamide.
Chemical Property Profile of 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium
Property Insights of 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium
The XLogP value of 2.2082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium. Following Lipinski's Rule of Five, 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium has 2 hydrogen bond donor(s) and 3 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 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium?
The CAS number of 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium is 393540-36-8.
What is the molecular formula of 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium?
The molecular formula of 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium is C21H18N3O3+.
What is the molecular weight of 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium?
The molecular weight of 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium is 360.13 g/mol.
Where can I buy 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium?
You can request a quote for 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Benzamidophenyl)-2-oxoethyl]-3-carbamoylpyridin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.