RefChem:476488
TL;DR: RefChem:476488 (CAS 63149-27-9) is a chemical compound with molecular formula C37H46N2O4 and molecular weight 582.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-aminophenoxy)-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxynaphthalene-2-carboxamide
Also Known As: 2-[(2-phenylethyl)amino]ethanethiol, 2-Naphthalenecarboxamide, 4-(4-aminophenoxy)-N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-, 2-Naphthalenecarboxamide, 4-(4-aminophenoxy)-N-(4-(2,4-bis(1,1-dimethylpropyl)phenoxy)butyl)-1-hydroxy-, 4-(4-aminophenoxy)-N-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-1-hydroxynaphthalene-2-carboxamide, 4-(4-aminophenoxy)-n-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-1-hydroxy-2-naphthamide
| Molecular Formula | C37H46N2O4 |
|---|---|
| Molecular Weight | 582.35 g/mol |
| LogP | 10.3 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 582.34576 |
| Heavy Atoms | 43 |
| Complexity | 854.0 |
Chemical Identifiers
| CAS Number | 63149-27-9 |
|---|---|
| SMILES | CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OC4=CC=C(C=C4)N)O)C(C)(C)CC |
| InChIKey | IRSKGCDDLMCVBY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:476488 (CAS 63149-27-9), with molecular formula C37H46N2O4 and molecular weight 582.35 g/mol. IUPAC: 4-(4-aminophenoxy)-N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxynaphthalene-2-carboxamide.
Chemical Property Profile of RefChem:476488
Property Insights of RefChem:476488
The XLogP value of 10.3 indicates that RefChem:476488 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:476488. Following Lipinski's Rule of Five, RefChem:476488 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:476488?
The CAS number of RefChem:476488 is 63149-27-9.
What is the molecular formula of RefChem:476488?
The molecular formula of RefChem:476488 is C37H46N2O4.
What is the molecular weight of RefChem:476488?
The molecular weight of RefChem:476488 is 582.35 g/mol.
Where can I buy RefChem:476488?
You can request a quote for RefChem:476488 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:476488?
Yes, KEHONG BIO provides custom synthesis services for RefChem:476488 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.