RefChem:1075208
TL;DR: RefChem:1075208 (CAS 132680-93-4) is a chemical compound with molecular formula C22H27ClN2O3 and molecular weight 402.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methylphenyl)acetamide;hydrochloride
Also Known As: Acetamide, 2-(3,4-dihydro-6,7-dimethoxy-3,3-dimethyl-1(2H)-isoquinolinylidene)-N-(4-methylphenyl)-, monohydrochloride, (Z)-, (2Z)-2-(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methylphenyl)acetamide hydrochloride, (2Z)-2-(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methylphenyl)acetamide,hydrochloride, 2-(6,7-dimethoxy-3,3-dimethyl(2,3,4-trihydroisoquinolylidene))-N-(4-methylphen yl)acetamide, chloride
| Molecular Formula | C22H27ClN2O3 |
|---|---|
| Molecular Weight | 402.17 g/mol |
| LogP | 4.33792 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.17102 |
| Heavy Atoms | 28 |
| Complexity | 889.4 |
Chemical Identifiers
| CAS Number | 132680-93-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)/C=C\2/C3=CC(=C(C=C3CC(N2)(C)C)OC)OC.Cl |
Product Overview
RefChem:1075208 (CAS 132680-93-4), with molecular formula C22H27ClN2O3 and molecular weight 402.17 g/mol. IUPAC: (2Z)-2-(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-N-(4-methylphenyl)acetamide;hydrochloride.
Chemical Property Profile of RefChem:1075208
Property Insights of RefChem:1075208
The XLogP value of 4.33792 indicates that RefChem:1075208 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, RefChem:1075208 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1075208 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 RefChem:1075208?
The CAS number of RefChem:1075208 is 132680-93-4.
What is the molecular formula of RefChem:1075208?
The molecular formula of RefChem:1075208 is C22H27ClN2O3.
What is the molecular weight of RefChem:1075208?
The molecular weight of RefChem:1075208 is 402.17 g/mol.
Where can I buy RefChem:1075208?
You can request a quote for RefChem:1075208 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1075208?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1075208 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.