MS 3 (enzyme inhibitor)
TL;DR: MS 3 (enzyme inhibitor) (CAS 58265-74-0) is a chemical compound with molecular formula C21H24O7 and molecular weight 388.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-hydroxy-4,5-bis(hydroxymethyl)-2-(3-methylbut-2-enyl)phenyl] 2,4-dihydroxy-6-methylbenzoate
Also Known As: amsacrine, Emulsifier OS, Glyo-I, MS 3 (enzyme inhibitor), MS 3
| Molecular Formula | C21H24O7 |
|---|---|
| Molecular Weight | 388.15 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.1522 |
| Heavy Atoms | 28 |
| Complexity | 545.0 |
| Melting Point | 92 °C |
Chemical Identifiers
| CAS Number | 58265-74-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C(=O)OC2=C(C(=C(C(=C2)CO)CO)O)CC=C(C)C)O)O |
| InChIKey | WTZUCTQSBSDSRG-UHFFFAOYSA-N |
Product Overview
MS 3 (enzyme inhibitor) (CAS 58265-74-0), with molecular formula C21H24O7 and molecular weight 388.15 g/mol. IUPAC: [3-hydroxy-4,5-bis(hydroxymethyl)-2-(3-methylbut-2-enyl)phenyl] 2,4-dihydroxy-6-methylbenzoate.
Chemical Property Profile of MS 3 (enzyme inhibitor)
Property Insights of MS 3 (enzyme inhibitor)
The XLogP value of 3.9 indicates that MS 3 (enzyme inhibitor) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for MS 3 (enzyme inhibitor). Following Lipinski's Rule of Five, MS 3 (enzyme inhibitor) has 5 hydrogen bond donor(s) and 7 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 MS 3 (enzyme inhibitor)?
The CAS number of MS 3 (enzyme inhibitor) is 58265-74-0.
What is the molecular formula of MS 3 (enzyme inhibitor)?
The molecular formula of MS 3 (enzyme inhibitor) is C21H24O7.
What is the molecular weight of MS 3 (enzyme inhibitor)?
The molecular weight of MS 3 (enzyme inhibitor) is 388.15 g/mol.
Where can I buy MS 3 (enzyme inhibitor)?
You can request a quote for MS 3 (enzyme inhibitor) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MS 3 (enzyme inhibitor)?
Yes, KEHONG BIO provides custom synthesis services for MS 3 (enzyme inhibitor) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.