MtUng-IN-1
TL;DR: MtUng-IN-1 (CAS 6138-21-2) is a chemical compound with molecular formula C14H12N2O6 and molecular weight 304.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetate
Also Known As: MtUng-IN-1, MtUng-IN-1?, BIM-0021674.P001, methyl 2-[4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetate, methyl {4-[(2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]phenoxy}acetate
| Molecular Formula | C14H12N2O6 |
|---|---|
| Molecular Weight | 304.07 g/mol |
| LogP | -0.0122 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.06955 |
| Heavy Atoms | 22 |
| Complexity | 640.4156 |
Chemical Identifiers
| CAS Number | 6138-21-2 |
|---|---|
| SMILES | COC(=O)COC1=CC=C(C=C1)C=C2C(=O)NC(=O)NC2=O |
Product Overview
MtUng-IN-1 (CAS 6138-21-2), with molecular formula C14H12N2O6 and molecular weight 304.07 g/mol. IUPAC: methyl 2-[4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetate.
Chemical Property Profile of MtUng-IN-1
Property Insights of MtUng-IN-1
The XLogP value of -0.0122 indicates that MtUng-IN-1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for MtUng-IN-1. Following Lipinski's Rule of Five, MtUng-IN-1 has 2 hydrogen bond donor(s) and 6 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 MtUng-IN-1?
The CAS number of MtUng-IN-1 is 6138-21-2.
What is the molecular formula of MtUng-IN-1?
The molecular formula of MtUng-IN-1 is C14H12N2O6.
What is the molecular weight of MtUng-IN-1?
The molecular weight of MtUng-IN-1 is 304.07 g/mol.
Where can I buy MtUng-IN-1?
You can request a quote for MtUng-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MtUng-IN-1?
Yes, KEHONG BIO provides custom synthesis services for MtUng-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.