1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide
TL;DR: 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide (CAS 627889-89-8) is a chemical compound with molecular formula C17H15NO4 and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methoxyphenyl)-1-oxo-3,4-dihydroisochromene-3-carboxamide
Also Known As: BAS 07776986, 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide, N-(2-methoxyphenyl)-1-oxoisochroman-3-carboxamide, N-(2-methoxyphenyl)(1-oxoisochroman-3-yl)carboxamide, N-(2-methoxyphenyl)-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide
| Molecular Formula | C17H15NO4 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 2.4154 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.1001 |
| Heavy Atoms | 22 |
| Complexity | 726.1038 |
Chemical Identifiers
| CAS Number | 627889-89-8 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)C2CC3=CC=CC=C3C(=O)O2 |
Product Overview
1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide (CAS 627889-89-8), with molecular formula C17H15NO4 and molecular weight 297.10 g/mol. IUPAC: N-(2-methoxyphenyl)-1-oxo-3,4-dihydroisochromene-3-carboxamide.
Chemical Property Profile of 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide
Property Insights of 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide
The XLogP value of 2.4154 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide. Following Lipinski's Rule of Five, 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide 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 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide?
The CAS number of 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide is 627889-89-8.
What is the molecular formula of 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide?
The molecular formula of 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide is C17H15NO4.
What is the molecular weight of 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide?
The molecular weight of 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide is 297.10 g/mol.
Where can I buy 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide?
You can request a quote for 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide?
Yes, KEHONG BIO provides custom synthesis services for 1-Oxo-isochroman-3-carboxylic acid (2-methoxy-phenyl)-amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.