Azaphenylalanine derivative
TL;DR: Azaphenylalanine derivative (CAS 673485-33-1) is a chemical compound with molecular formula C25H29N5O3S and molecular weight 479.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[azepane-1-carbonyl-(naphthalen-2-ylsulfonylamino)amino]methyl]benzenecarboximidamide
Also Known As: Azaphenylalanine derivative, J2.098.007I, 3-((N'-(Azepane-1-carbonyl)(naphthalen-2-yl)hydrazinesulfonyl)methyl)benzene-1-carboximidamide, 1H-Azepine-1-carboxylic acid, hexahydro-, 1-((3-(aminoiminomethyl)phenyl)methyl)-2-(2-naphthalenylsulfonyl)hydrazide, 2-Naphthalenesulfonic acid, 2-((3-(aminoiminomethyl)phenyl)methyl)-2-((hexahydro-1H-azepin-1-yl)carbonyl)hydrazide
| Molecular Formula | C25H29N5O3S |
|---|---|
| Molecular Weight | 479.20 g/mol |
| LogP | 3.81537 |
| Topological Polar Surface Area | 119.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.1991 |
| Heavy Atoms | 34 |
| Complexity | 1300.6588 |
Chemical Identifiers
| CAS Number | 673485-33-1 |
|---|---|
| SMILES | C1CCCN(CC1)C(=O)N(CC2=CC(=CC=C2)C(=N)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3 |
Product Overview
Azaphenylalanine derivative (CAS 673485-33-1), with molecular formula C25H29N5O3S and molecular weight 479.20 g/mol. IUPAC: 3-[[azepane-1-carbonyl-(naphthalen-2-ylsulfonylamino)amino]methyl]benzenecarboximidamide.
Chemical Property Profile of Azaphenylalanine derivative
Property Insights of Azaphenylalanine derivative
The XLogP value of 3.81537 indicates that Azaphenylalanine derivative is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Azaphenylalanine derivative. Following Lipinski's Rule of Five, Azaphenylalanine derivative has 3 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 Azaphenylalanine derivative?
The CAS number of Azaphenylalanine derivative is 673485-33-1.
What is the molecular formula of Azaphenylalanine derivative?
The molecular formula of Azaphenylalanine derivative is C25H29N5O3S.
What is the molecular weight of Azaphenylalanine derivative?
The molecular weight of Azaphenylalanine derivative is 479.20 g/mol.
Where can I buy Azaphenylalanine derivative?
You can request a quote for Azaphenylalanine derivative directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azaphenylalanine derivative?
Yes, KEHONG BIO provides custom synthesis services for Azaphenylalanine derivative and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.