![N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide structure](/static/products/6270/627062-19-5.webp)
N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide
TL;DR: N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide (CAS 627062-19-5) is a chemical compound with molecular formula C17H17N3O and molecular weight 279.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[amino(3,4-dihydro-1H-isoquinolin-2-yl)methylidene]benzamide
Also Known As: N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide, AJ-292/41686314, N-[amino(3,4-dihydro-1H-isoquinolin-2-yl)methylidene]benzamide, N-[amino-(3,4-dihydro-1H-isoquinolin-2-yl)methylidene]benzamide, Cambridge id 7260975
| Molecular Formula | C17H17N3O |
|---|---|
| Molecular Weight | 279.14 g/mol |
| LogP | 2.1998 |
| Topological Polar Surface Area | 58.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.13718 |
| Heavy Atoms | 21 |
| Complexity | 679.4444 |
Chemical Identifiers
| CAS Number | 627062-19-5 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=NC(=O)C3=CC=CC=C3)N |
Product Overview
N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide (CAS 627062-19-5), with molecular formula C17H17N3O and molecular weight 279.14 g/mol. IUPAC: N-[amino(3,4-dihydro-1H-isoquinolin-2-yl)methylidene]benzamide.
Chemical Property Profile of N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide
Property Insights of N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide
The XLogP value of 2.1998 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide. With a topological polar surface area (TPSA) of 58.69 Ų, N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide has 1 hydrogen bond donor(s) and 1 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-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide?
The CAS number of N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide is 627062-19-5.
What is the molecular formula of N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide?
The molecular formula of N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide is C17H17N3O.
What is the molecular weight of N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide?
The molecular weight of N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide is 279.14 g/mol.
Where can I buy N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide?
You can request a quote for N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3,4-dihydroisoquinolin-2(1H)-yl(imino)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.