Metachromin C
TL;DR: Metachromin C (CAS 124596-50-5) is a chemical compound with molecular formula C22H30O4 and molecular weight 358.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-methoxy-3-[(E)-3-methyl-5-[(1R,2S)-1,2,3-trimethylcyclohex-3-en-1-yl]pent-2-enyl]cyclohexa-2,5-diene-1,4-dione
Also Known As: Metachromin C, 2-hydroxy-5-methoxy-3-[(E)-3-methyl-5-[(1R,2S)-1,2,3-trimethylcyclohex-3-en-1-yl]pent-2-enyl]cyclohexa-2,5-diene-1,4-dione, 2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-(3-methyl-5-(1,2,3-trimethyl-3-cyclohexen-1-yl)-2-pentenyl)-, (1R-(1alpha(E),2alpha))-, 2-hydroxy-5-methoxy-3-((E)-3-methyl-5-((1R,2S)-1,2,3-trimethylcyclohex-3-en-1-yl)pent-2-enyl)cyclohexa-2,5-diene-1,4-dione, 2-HYDROXY-5-METHOXY-3-[(2E)-3-METHYL-5-[(1R,2S)-1,2,3-TRIMETHYLCYCLOHEX-3-EN-1-YL]PENT-2-EN-1-YL]CYCLOHEXA-2,5-DIENE-1,4-DIONE
| Molecular Formula | C22H30O4 |
|---|---|
| Molecular Weight | 358.21 g/mol |
| LogP | 4.9797 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.21442 |
| Heavy Atoms | 26 |
| Complexity | 720.42426 |
Chemical Identifiers
| CAS Number | 124596-50-5 |
|---|---|
| SMILES | C[C@@H]1C(=CCC[C@]1(C)CC/C(=C/CC2=C(C(=O)C=C(C2=O)OC)O)/C)C |
Product Overview
Metachromin C (CAS 124596-50-5), with molecular formula C22H30O4 and molecular weight 358.21 g/mol. IUPAC: 2-hydroxy-5-methoxy-3-[(E)-3-methyl-5-[(1R,2S)-1,2,3-trimethylcyclohex-3-en-1-yl]pent-2-enyl]cyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of Metachromin C
Property Insights of Metachromin C
The XLogP value of 4.9797 indicates that Metachromin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Metachromin C. Following Lipinski's Rule of Five, Metachromin C has 1 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 Metachromin C?
The CAS number of Metachromin C is 124596-50-5.
What is the molecular formula of Metachromin C?
The molecular formula of Metachromin C is C22H30O4.
What is the molecular weight of Metachromin C?
The molecular weight of Metachromin C is 358.21 g/mol.
Where can I buy Metachromin C?
You can request a quote for Metachromin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Metachromin C?
Yes, KEHONG BIO provides custom synthesis services for Metachromin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.