1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine
TL;DR: 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine (CAS 774554-30-2) is a chemical compound with molecular formula C16H20BrNO2S and molecular weight 369.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromo-4,5-diethoxyphenyl)methyl]-1-thiophen-2-ylmethanamine
Also Known As: AP-970/42525164, (3-Bromo-4,5-diethoxy-benzyl)-thiophen-2-ylmethyl-amine, 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine, N-(3-bromo-4,5-diethoxybenzyl)-N-(2-thienylmethyl)amine, N-[(3-bromo-4,5-diethoxyphenyl)methyl]-1-thiophen-2-ylmethanamine
| Molecular Formula | C16H20BrNO2S |
|---|---|
| Molecular Weight | 369.04 g/mol |
| LogP | 4.5978 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 369.0398 |
| Heavy Atoms | 21 |
| Complexity | 557.65466 |
Chemical Identifiers
| CAS Number | 774554-30-2 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)CNCC2=CC=CS2)Br)OCC |
Product Overview
1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine (CAS 774554-30-2), with molecular formula C16H20BrNO2S and molecular weight 369.04 g/mol. IUPAC: N-[(3-bromo-4,5-diethoxyphenyl)methyl]-1-thiophen-2-ylmethanamine.
Chemical Property Profile of 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine
Property Insights of 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine
The XLogP value of 4.5978 indicates that 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine 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 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine?
The CAS number of 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine is 774554-30-2.
What is the molecular formula of 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine?
The molecular formula of 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine is C16H20BrNO2S.
What is the molecular weight of 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine?
The molecular weight of 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine is 369.04 g/mol.
Where can I buy 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine?
You can request a quote for 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-bromo-4,5-diethoxyphenyl)-N-(thiophen-2-ylmethyl)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.