![N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide structure](/static/products/461/461429-71-0.png)
N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide
TL;DR: N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide (CAS 461429-71-0) is a chemical compound with molecular formula C19H19N3O3 and molecular weight 337.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxy-1,3-dimethyl-8-oxocyclohepta[c]pyrrol-2-yl)pyridine-4-carboxamide
Also Known As: N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide, 8-ethoxy-1,3-dimethyl-2-[(pyridin-4-ylcarbonyl)amino]cyclohepta[c]pyrrolium-4-olate, N-(4-ethoxy-1,3-dimethyl-8-oxocyclohepta[c]pyrrol-2-yl)pyridine-4-carboxamide
| Molecular Formula | C19H19N3O3 |
|---|---|
| Molecular Weight | 337.14 g/mol |
| LogP | 2.79594 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.14264 |
| Heavy Atoms | 25 |
| Complexity | 994.2072 |
Chemical Identifiers
| CAS Number | 461429-71-0 |
|---|---|
| SMILES | CCOC1=CC=CC(=O)C2=C(N(C(=C12)C)NC(=O)C3=CC=NC=C3)C |
Product Overview
N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide (CAS 461429-71-0), with molecular formula C19H19N3O3 and molecular weight 337.14 g/mol. IUPAC: N-(4-ethoxy-1,3-dimethyl-8-oxocyclohepta[c]pyrrol-2-yl)pyridine-4-carboxamide.
Chemical Property Profile of N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide
Property Insights of N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide
The XLogP value of 2.79594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide. Following Lipinski's Rule of Five, N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide has 1 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-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide?
The CAS number of N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide is 461429-71-0.
What is the molecular formula of N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide?
The molecular formula of N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide is C19H19N3O3.
What is the molecular weight of N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide?
The molecular weight of N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide is 337.14 g/mol.
Where can I buy N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide?
You can request a quote for N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)isonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.