(2-Aminophenyl)(4-methoxybenzyl)amine
TL;DR: (2-Aminophenyl)(4-methoxybenzyl)amine (CAS 5774-50-5) is a chemical compound with molecular formula C14H16N2O and molecular weight 228.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-N-[(4-methoxyphenyl)methyl]benzene-1,2-diamine
Also Known As: (2-aminophenyl)(4-methoxybenzyl)amine, N1-(4-Methoxybenzyl)benzene-1,2-diamine, 2,3-difluorophenylthiourea, n-(4-methoxybenzyl)benzene-1,2-diamine, CHEMBRDG-BB 9071320
| Molecular Formula | C14H16N2O |
|---|---|
| Molecular Weight | 228.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.12627 |
| Heavy Atoms | 17 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 5774-50-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC2=CC=CC=C2N |
| InChIKey | WLHZVTMHNONISE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2-Aminophenyl)(4-methoxybenzyl)amine (CAS 5774-50-5), with molecular formula C14H16N2O and molecular weight 228.13 g/mol. IUPAC: 2-N-[(4-methoxyphenyl)methyl]benzene-1,2-diamine.
Chemical Property Profile of (2-Aminophenyl)(4-methoxybenzyl)amine
Property Insights of (2-Aminophenyl)(4-methoxybenzyl)amine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Aminophenyl)(4-methoxybenzyl)amine. With a topological polar surface area (TPSA) of 47.3 Ų, (2-Aminophenyl)(4-methoxybenzyl)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Aminophenyl)(4-methoxybenzyl)amine has 2 hydrogen bond donor(s) and 3 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-Aminophenyl)(4-methoxybenzyl)amine?
The CAS number of (2-Aminophenyl)(4-methoxybenzyl)amine is 5774-50-5.
What is the molecular formula of (2-Aminophenyl)(4-methoxybenzyl)amine?
The molecular formula of (2-Aminophenyl)(4-methoxybenzyl)amine is C14H16N2O.
What is the molecular weight of (2-Aminophenyl)(4-methoxybenzyl)amine?
The molecular weight of (2-Aminophenyl)(4-methoxybenzyl)amine is 228.13 g/mol.
Where can I buy (2-Aminophenyl)(4-methoxybenzyl)amine?
You can request a quote for (2-Aminophenyl)(4-methoxybenzyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Aminophenyl)(4-methoxybenzyl)amine?
Yes, KEHONG BIO provides custom synthesis services for (2-Aminophenyl)(4-methoxybenzyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.