N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide
TL;DR: N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide (CAS 868213-13-2) is a chemical compound with molecular formula C19H18N2O4 and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide
Also Known As: BAS 10258085, F1762-0579, N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide, N-(4-acetamidophenyl)-3-methyl-1-oxoisochroman-3-carboxamide, N-(4-acetamidophenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
| Molecular Formula | C19H18N2O4 |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 2.7553 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.12665 |
| Heavy Atoms | 25 |
| Complexity | 844.7575 |
Chemical Identifiers
| CAS Number | 868213-13-2 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C |
Product Overview
N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide (CAS 868213-13-2), with molecular formula C19H18N2O4 and molecular weight 338.13 g/mol. IUPAC: N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide.
Chemical Property Profile of N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide
Property Insights of N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide
The XLogP value of 2.7553 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide. Following Lipinski's Rule of Five, N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide 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-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide?
The CAS number of N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide is 868213-13-2.
What is the molecular formula of N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide?
The molecular formula of N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide is C19H18N2O4.
What is the molecular weight of N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide?
The molecular weight of N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide is 338.13 g/mol.
Where can I buy N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide?
You can request a quote for N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-acetamidophenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.