丁苯羟酸
TL;DR: 丁苯羟酸 (CAS 2438-72-4) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁苯羟酸
2-(4-butoxyphenyl)-N-hydroxyacetamide
Also Known As: bufexamac, Bufexamic acid, Parfenac, Anderm, Droxaryl
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 200.0 |
| Melting Point | 153 |
| Solubility | Immiscible |
Chemical Identifiers
| CAS Number | 2438-72-4 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)CC(=O)NO |
| InChIKey | MXJWRABVEGLYDG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁苯羟酸 (CAS 2438-72-4), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: 2-(4-butoxyphenyl)-N-hydroxyacetamide.
Chemical Property Profile of 丁苯羟酸
Property Insights of 丁苯羟酸
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丁苯羟酸. With a topological polar surface area (TPSA) of 58.6 Ų, 丁苯羟酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁苯羟酸 has 2 hydrogen bond donor(s) and 3 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 丁苯羟酸?
The CAS number of 丁苯羟酸 is 2438-72-4.
What is the molecular formula of 丁苯羟酸?
The molecular formula of 丁苯羟酸 is C12H17NO3.
What is the molecular weight of 丁苯羟酸?
The molecular weight of 丁苯羟酸 is 223.12 g/mol.
Where can I buy 丁苯羟酸?
You can request a quote for 丁苯羟酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁苯羟酸?
Yes, KEHONG BIO provides custom synthesis services for 丁苯羟酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.