RefChem:476545
TL;DR: RefChem:476545 (CAS 32180-75-9) is a chemical compound with molecular formula C31H41NO3 and molecular weight 475.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxynaphthalene-2-carboxamide
Also Known As: ChemDiv1_019776, 2-fluoro-5-hydroxybenzoic acid, CALCIUML-GLUTAMATE2-HYDRATE, N-(4-(2,4-Di-tert-pentylphenoxy)butyl)-1-hydroxy-2-naphthamide, N-{4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}-1-hydroxynaphthalene-2-carboxamide
| Molecular Formula | C31H41NO3 |
|---|---|
| Molecular Weight | 475.31 g/mol |
| LogP | 9.5 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 475.30865 |
| Heavy Atoms | 35 |
| Complexity | 660.0 |
Chemical Identifiers
| CAS Number | 32180-75-9 |
|---|---|
| SMILES | CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C=C2)O)C(C)(C)CC |
| InChIKey | DHEJKONKJWLHGP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:476545 (CAS 32180-75-9), with molecular formula C31H41NO3 and molecular weight 475.31 g/mol. IUPAC: N-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl]-1-hydroxynaphthalene-2-carboxamide.
Chemical Property Profile of RefChem:476545
Property Insights of RefChem:476545
The XLogP value of 9.5 indicates that RefChem:476545 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, RefChem:476545 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:476545 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:476545?
The CAS number of RefChem:476545 is 32180-75-9.
What is the molecular formula of RefChem:476545?
The molecular formula of RefChem:476545 is C31H41NO3.
What is the molecular weight of RefChem:476545?
The molecular weight of RefChem:476545 is 475.31 g/mol.
Where can I buy RefChem:476545?
You can request a quote for RefChem:476545 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:476545?
Yes, KEHONG BIO provides custom synthesis services for RefChem:476545 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.