Hydroxyzomepirac
TL;DR: Hydroxyzomepirac (CAS 72155-04-5) is a chemical compound with molecular formula C15H14ClNO4 and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(4-chlorobenzoyl)-4-(hydroxymethyl)-1-methylpyrrol-2-yl]acetic acid
Also Known As: Hydroxyzomepirac, 5-(4-Chlorobenzoyl)-4-(hydroxymethyl)-1-methyl-1H-pyrrole-2-acetic acid, 2-[5-(4-chlorobenzoyl)-4-(hydroxymethyl)-1-methylpyrrol-2-yl]acetic acid, 1H-Pyrrole-2-acetic acid, 5-(4-chlorobenzoyl)-4-(hydroxymethyl)-1-methyl-, 1H-Pyrrole-2-aceticacid, 5-(4-chlorobenzoyl)-4-(hydroxymethyl)-1-methyl-
| Molecular Formula | C15H14ClNO4 |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.06113 |
| Heavy Atoms | 21 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 72155-04-5 |
|---|---|
| SMILES | CN1C(=CC(=C1C(=O)C2=CC=C(C=C2)Cl)CO)CC(=O)O |
| InChIKey | FBQJXWWENUWXNP-UHFFFAOYSA-N |
Product Overview
Hydroxyzomepirac (CAS 72155-04-5), with molecular formula C15H14ClNO4 and molecular weight 307.06 g/mol. IUPAC: 2-[5-(4-chlorobenzoyl)-4-(hydroxymethyl)-1-methylpyrrol-2-yl]acetic acid.
Chemical Property Profile of Hydroxyzomepirac
Property Insights of Hydroxyzomepirac
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxyzomepirac. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxyzomepirac. Following Lipinski's Rule of Five, Hydroxyzomepirac has 2 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 Hydroxyzomepirac?
The CAS number of Hydroxyzomepirac is 72155-04-5.
What is the molecular formula of Hydroxyzomepirac?
The molecular formula of Hydroxyzomepirac is C15H14ClNO4.
What is the molecular weight of Hydroxyzomepirac?
The molecular weight of Hydroxyzomepirac is 307.06 g/mol.
Where can I buy Hydroxyzomepirac?
You can request a quote for Hydroxyzomepirac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxyzomepirac?
Yes, KEHONG BIO provides custom synthesis services for Hydroxyzomepirac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.