Ro 46-2005
TL;DR: Ro 46-2005 (CAS 150725-87-4) is a chemical compound with molecular formula C23H27N3O6S and molecular weight 473.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide
Also Known As: Ro 46-2005, Ro-46-2005, ro46-2005, 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide, Ro 462005
| Molecular Formula | C23H27N3O6S |
|---|---|
| Molecular Weight | 473.16 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 473.16205 |
| Heavy Atoms | 33 |
| Complexity | 687.0 |
Chemical Identifiers
| CAS Number | 150725-87-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCO)OC3=CC=CC(=C3)OC |
| InChIKey | ZNXOKLWCOWOECF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ro 46-2005 (CAS 150725-87-4), with molecular formula C23H27N3O6S and molecular weight 473.16 g/mol. IUPAC: 4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(3-methoxyphenoxy)pyrimidin-4-yl]benzenesulfonamide.
Chemical Property Profile of Ro 46-2005
Property Insights of Ro 46-2005
The XLogP value of 4.0 indicates that Ro 46-2005 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ro 46-2005. Following Lipinski's Rule of Five, Ro 46-2005 has 2 hydrogen bond donor(s) and 9 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 Ro 46-2005?
The CAS number of Ro 46-2005 is 150725-87-4.
What is the molecular formula of Ro 46-2005?
The molecular formula of Ro 46-2005 is C23H27N3O6S.
What is the molecular weight of Ro 46-2005?
The molecular weight of Ro 46-2005 is 473.16 g/mol.
Where can I buy Ro 46-2005?
You can request a quote for Ro 46-2005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ro 46-2005?
Yes, KEHONG BIO provides custom synthesis services for Ro 46-2005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.