2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID
TL;DR: 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID (CAS 313704-65-3) is a chemical compound with molecular formula C14H10Cl2N2O6 and molecular weight 371.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,6-dichloro-4-[(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid
Also Known As: 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID, 2-(2,6-dichloro-4-((1-methyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)phenoxy)acetic acid, 2-[2,6-dichloro-4-[(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid
| Molecular Formula | C14H10Cl2N2O6 |
|---|---|
| Molecular Weight | 371.99 g/mol |
| LogP | 1.5484 |
| Topological Polar Surface Area | 113.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.99158 |
| Heavy Atoms | 24 |
| Complexity | 766.4645 |
Chemical Identifiers
| CAS Number | 313704-65-3 |
|---|---|
| SMILES | CN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC(=O)O)Cl)C(=O)NC1=O |
Product Overview
2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID (CAS 313704-65-3), with molecular formula C14H10Cl2N2O6 and molecular weight 371.99 g/mol. IUPAC: 2-[2,6-dichloro-4-[(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetic acid.
Chemical Property Profile of 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID
Property Insights of 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID
The XLogP value of 1.5484 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID. The TPSA of 113.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID. Following Lipinski's Rule of Five, 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID has 2 hydrogen bond donor(s) and 5 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 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID?
The CAS number of 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID is 313704-65-3.
What is the molecular formula of 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID?
The molecular formula of 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID is C14H10Cl2N2O6.
What is the molecular weight of 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID?
The molecular weight of 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID is 371.99 g/mol.
Where can I buy 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID?
You can request a quote for 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID?
Yes, KEHONG BIO provides custom synthesis services for 2,6-DICHLORO-4-{[(5Z)-1-METHYL-2,4,6-TRIOXO-1,3-DIAZINAN-5-YLIDENE]METHYL}PHENOXYACETIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.