4-bromo-N-(furan-2-ylmethyl)-3-methylaniline
TL;DR: 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline (CAS 303135-24-2) is a chemical compound with molecular formula C12H12BrNO and molecular weight 265.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-(furan-2-ylmethyl)-3-methylaniline
Also Known As: 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline, 4-bromo-N-[(furan-2-yl)methyl]-3-methylaniline, 4-bromo-N-(2-furylmethyl)-3-methyl-aniline, (4-bromo-3-methylphenyl)(2-furylmethyl)amine, N-(4-bromo-3-methylphenyl)-N-(2-furylmethyl)amine
| Molecular Formula | C12H12BrNO |
|---|---|
| Molecular Weight | 265.01 g/mol |
| LogP | 3.96262 |
| Topological Polar Surface Area | 25.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 265.01022 |
| Heavy Atoms | 15 |
| Complexity | 436.8877 |
Chemical Identifiers
| CAS Number | 303135-24-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NCC2=CC=CO2)Br |
Product Overview
4-bromo-N-(furan-2-ylmethyl)-3-methylaniline (CAS 303135-24-2), with molecular formula C12H12BrNO and molecular weight 265.01 g/mol. IUPAC: 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline.
Chemical Property Profile of 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline
Property Insights of 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline
The XLogP value of 3.96262 indicates that 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.17 Ų, 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline has 1 hydrogen bond donor(s) and 2 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 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline?
The CAS number of 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline is 303135-24-2.
What is the molecular formula of 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline?
The molecular formula of 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline is C12H12BrNO.
What is the molecular weight of 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline?
The molecular weight of 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline is 265.01 g/mol.
Where can I buy 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline?
You can request a quote for 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(furan-2-ylmethyl)-3-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.