RefChem:378463
TL;DR: RefChem:378463 (CAS 27114-36-9) is a chemical compound with molecular formula C20H28Cl2N2O2 and molecular weight 398.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-N-(1,2,3,4-tetrahydroquinolin-2-ylmethyl)ethanamine;dihydrochloride
Also Known As: Quinoline, 1,2,3,4-tetrahydro-2-((3,4-dimethoxyphenethylamino)methyl)-, dihydrochloride, Quinoline, 2-((3,4-dimethoxyphenethylamino)methyl)-1,2,3,4-tetrahydro-, dihydrochloride, 2-(3,4-dimethoxyphenyl)-n-(1,2,3,4-tetrahydroquinolin-2-ylmethyl)ethanamine dihydrochloride, Quinoline, 2-[[(3,4-dimethoxyphenethyl)amino]methyl]-1,2,3,4-tetrahydro-, dihydrochloride, 2-(3,4-Dimethoxyphenyl)-N-[(1,2,3,4-tetrahydroquinolin-2-yl)methyl]ethan-1-amine--hydrogen chloride (1/2)
| Molecular Formula | C20H28Cl2N2O2 |
|---|---|
| Molecular Weight | 398.15 g/mol |
| LogP | 4.11 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 398.15277 |
| Heavy Atoms | 26 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 27114-36-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNCC2CCC3=CC=CC=C3N2)OC.Cl.Cl |
| InChIKey | HZWYCZUXPQNXPD-UHFFFAOYSA-N |
Product Overview
RefChem:378463 (CAS 27114-36-9), with molecular formula C20H28Cl2N2O2 and molecular weight 398.15 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-N-(1,2,3,4-tetrahydroquinolin-2-ylmethyl)ethanamine;dihydrochloride.
Chemical Property Profile of RefChem:378463
Property Insights of RefChem:378463
The XLogP value of 4.11 indicates that RefChem:378463 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, RefChem:378463 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:378463 has 4 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:378463?
The CAS number of RefChem:378463 is 27114-36-9.
What is the molecular formula of RefChem:378463?
The molecular formula of RefChem:378463 is C20H28Cl2N2O2.
What is the molecular weight of RefChem:378463?
The molecular weight of RefChem:378463 is 398.15 g/mol.
Where can I buy RefChem:378463?
You can request a quote for RefChem:378463 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:378463?
Yes, KEHONG BIO provides custom synthesis services for RefChem:378463 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.