N-isoquinolin-1-yl-3-methoxybenzamide
TL;DR: N-isoquinolin-1-yl-3-methoxybenzamide (CAS 40339-90-0) is a chemical compound with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-isoquinolin-1-yl-3-methoxybenzamide
Also Known As: N-isoquinolin-1-yl-3-methoxybenzamide, Benzamide, N-1-isoquinolinyl-3-methoxy-, N-(isoquinolin-1-yl)-3-methoxybenzamide, N-(1-Isoquinolyl)-3-methoxybenzamide, N-(1-Isoquinolinyl)-3-methoxybenzamide
| Molecular Formula | C17H14N2O2 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.10553 |
| Heavy Atoms | 21 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 40339-90-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)NC2=NC=CC3=CC=CC=C32 |
| InChIKey | HBKRCFLMDNXURL-UHFFFAOYSA-N |
Product Overview
N-isoquinolin-1-yl-3-methoxybenzamide (CAS 40339-90-0), with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol. IUPAC: N-isoquinolin-1-yl-3-methoxybenzamide.
Chemical Property Profile of N-isoquinolin-1-yl-3-methoxybenzamide
Property Insights of N-isoquinolin-1-yl-3-methoxybenzamide
The XLogP value of 3.2 indicates that N-isoquinolin-1-yl-3-methoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, N-isoquinolin-1-yl-3-methoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isoquinolin-1-yl-3-methoxybenzamide has 1 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 N-isoquinolin-1-yl-3-methoxybenzamide?
The CAS number of N-isoquinolin-1-yl-3-methoxybenzamide is 40339-90-0.
What is the molecular formula of N-isoquinolin-1-yl-3-methoxybenzamide?
The molecular formula of N-isoquinolin-1-yl-3-methoxybenzamide is C17H14N2O2.
What is the molecular weight of N-isoquinolin-1-yl-3-methoxybenzamide?
The molecular weight of N-isoquinolin-1-yl-3-methoxybenzamide is 278.11 g/mol.
Where can I buy N-isoquinolin-1-yl-3-methoxybenzamide?
You can request a quote for N-isoquinolin-1-yl-3-methoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isoquinolin-1-yl-3-methoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-isoquinolin-1-yl-3-methoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.