Verrucarin E
TL;DR: Verrucarin E (CAS 24445-13-4) is a chemical compound with molecular formula C7H9NO2 and molecular weight 139.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(hydroxymethyl)-1H-pyrrol-3-yl]ethanone
Also Known As: Verrucarin E, 4-Acetyl-3-hydroxymethylpyrrole, 3-Acetyl-4-hydroxymethylpyrrol, 1-[4-(hydroxymethyl)-1H-pyrrol-3-yl]ethanone, 3-Acetyl-4-(hydroxymethyl)pyrrole
| Molecular Formula | C7H9NO2 |
|---|---|
| Molecular Weight | 139.06 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 139.06332 |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 24445-13-4 |
|---|---|
| SMILES | CC(=O)C1=CNC=C1CO |
| InChIKey | ZCTFIKLDSSVBAL-UHFFFAOYSA-N |
Product Overview
Verrucarin E (CAS 24445-13-4), with molecular formula C7H9NO2 and molecular weight 139.06 g/mol. IUPAC: 1-[4-(hydroxymethyl)-1H-pyrrol-3-yl]ethanone.
Chemical Property Profile of Verrucarin E
Property Insights of Verrucarin E
The XLogP value of -0.5 indicates that Verrucarin E is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.1 Ų, Verrucarin E exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Verrucarin E has 2 hydrogen bond donor(s) and 2 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 Verrucarin E?
The CAS number of Verrucarin E is 24445-13-4.
What is the molecular formula of Verrucarin E?
The molecular formula of Verrucarin E is C7H9NO2.
What is the molecular weight of Verrucarin E?
The molecular weight of Verrucarin E is 139.06 g/mol.
Where can I buy Verrucarin E?
You can request a quote for Verrucarin E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Verrucarin E?
Yes, KEHONG BIO provides custom synthesis services for Verrucarin E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.