![4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide structure](/static/products/359/359599-76-1.png)
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide
TL;DR: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide (CAS 359599-76-1) is a chemical compound with molecular formula C28H31N3O and molecular weight 425.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-(4-tert-butylphenyl)methylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide
Also Known As: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide, (E)-N'-(4-(tert-butyl)benzylidene)-4-((3,4-dihydroisoquinolin-2(1H)-yl)methyl)benzohydrazide, N'-[(E)-(4-tert-butylphenyl)methylidene]-4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)benzohydrazide, N-[(E)-(4-tert-butylphenyl)methylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide
| Molecular Formula | C28H31N3O |
|---|---|
| Molecular Weight | 425.25 g/mol |
| LogP | 5.3063 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.2467 |
| Heavy Atoms | 32 |
| Complexity | 1092.7715 |
Chemical Identifiers
| CAS Number | 359599-76-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)/C=N/NC(=O)C2=CC=C(C=C2)CN3CCC4=CC=CC=C4C3 |
Product Overview
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide (CAS 359599-76-1), with molecular formula C28H31N3O and molecular weight 425.25 g/mol. IUPAC: N-[(E)-(4-tert-butylphenyl)methylideneamino]-4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)benzamide.
Chemical Property Profile of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide
Property Insights of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide
The XLogP value of 5.3063 indicates that 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide?
The CAS number of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide is 359599-76-1.
What is the molecular formula of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide?
The molecular formula of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide is C28H31N3O.
What is the molecular weight of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide?
The molecular weight of 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide is 425.25 g/mol.
Where can I buy 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide?
You can request a quote for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(4-tert-butylphenyl)methylideneamino]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.