2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺
TL;DR: 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 (CAS 93428-72-9) is a chemical compound with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺
2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)ethanamine
Also Known As: NCIStruc1_001715, NCIStruc2_001069, NCI60_001086, 2-(6,7-dimethoxy-3,4-dihydroisoquinolyl)ethylamine, 1-Isoquinolineethanamine, 3,4-dihydro-6,7-dimethoxy-
| Molecular Formula | C13H18N2O2 |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.13683 |
| Heavy Atoms | 17 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 93428-72-9 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CCN=C2CCN)OC |
| InChIKey | FTTGFTOQWXLSSZ-UHFFFAOYSA-N |
Product Overview
2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 (CAS 93428-72-9), with molecular formula C13H18N2O2 and molecular weight 234.14 g/mol. IUPAC: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)ethanamine.
Chemical Property Profile of 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺
Property Insights of 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺. With a topological polar surface area (TPSA) of 56.8 Ų, 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 has 1 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 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺?
The CAS number of 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 is 93428-72-9.
What is the molecular formula of 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺?
The molecular formula of 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 is C13H18N2O2.
What is the molecular weight of 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺?
The molecular weight of 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 is 234.14 g/mol.
Where can I buy 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺?
You can request a quote for 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺?
Yes, KEHONG BIO provides custom synthesis services for 2-(6,7-二甲氧基-3,4-二氢异喹啉基)乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.