2-(2-cyanophenoxy)ethylamine
TL;DR: 2-(2-cyanophenoxy)ethylamine (CAS 57278-41-8) is a chemical compound with molecular formula C21H25N5O2S and molecular weight 411.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2,4-diamino-6-methylpyrimidin-5-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide
Also Known As: 2-(2-cyanophenoxy)ethylamine, N-[3-(2,4-DIAMINO-6-METHYL-PYRIMIDIN-5-YL)PROPYL]-4-METHYL-N-PHENYL-BENZENESULFONAMIDE, N-[3-(2,4-diamino-6-methylpyrimidin-5-yl)propyl]-4-methyl-N-, N-[3-(2,4-diamino-6-methylpyrimidin-5-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide, N-[3-(2,4-Diamino-6-methylpyrimidin-5-yl)propyl]-4-methyl-N-phenylbenzene-1-sulfonamide
| Molecular Formula | C21H25N5O2S |
|---|---|
| Molecular Weight | 411.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.17288 |
| Heavy Atoms | 29 |
| Complexity | 597.0 |
Chemical Identifiers
| CAS Number | 57278-41-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CCCC2=C(N=C(N=C2N)N)C)C3=CC=CC=C3 |
| InChIKey | XYRUYFPPRLOTIN-UHFFFAOYSA-N |
Product Overview
2-(2-cyanophenoxy)ethylamine (CAS 57278-41-8), with molecular formula C21H25N5O2S and molecular weight 411.17 g/mol. IUPAC: N-[3-(2,4-diamino-6-methylpyrimidin-5-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide.
Chemical Property Profile of 2-(2-cyanophenoxy)ethylamine
Property Insights of 2-(2-cyanophenoxy)ethylamine
The XLogP value of 3.3 indicates that 2-(2-cyanophenoxy)ethylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-cyanophenoxy)ethylamine. Following Lipinski's Rule of Five, 2-(2-cyanophenoxy)ethylamine has 2 hydrogen bond donor(s) and 7 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-(2-cyanophenoxy)ethylamine?
The CAS number of 2-(2-cyanophenoxy)ethylamine is 57278-41-8.
What is the molecular formula of 2-(2-cyanophenoxy)ethylamine?
The molecular formula of 2-(2-cyanophenoxy)ethylamine is C21H25N5O2S.
What is the molecular weight of 2-(2-cyanophenoxy)ethylamine?
The molecular weight of 2-(2-cyanophenoxy)ethylamine is 411.17 g/mol.
Where can I buy 2-(2-cyanophenoxy)ethylamine?
You can request a quote for 2-(2-cyanophenoxy)ethylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-cyanophenoxy)ethylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-cyanophenoxy)ethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.