3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid
TL;DR: 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid (CAS 587012-01-9) is a chemical compound with molecular formula C16H18N2O6 and molecular weight 334.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic acid
Also Known As: 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid, 3-(1,3-dimethyl-2,4,6-trioxohexahydropyrimidin-5-yl)-3-(4-methoxyphenyl)propanoic acid
| Molecular Formula | C16H18N2O6 |
|---|---|
| Molecular Weight | 334.12 g/mol |
| LogP | 0.9201 |
| Topological Polar Surface Area | 104.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.1165 |
| Heavy Atoms | 24 |
| Complexity | 660.313 |
Chemical Identifiers
| CAS Number | 587012-01-9 |
|---|---|
| SMILES | CN1C(=O)C(C(=O)N(C1=O)C)C(CC(=O)O)C2=CC=C(C=C2)OC |
Product Overview
3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid (CAS 587012-01-9), with molecular formula C16H18N2O6 and molecular weight 334.12 g/mol. IUPAC: 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic acid.
Chemical Property Profile of 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid
Property Insights of 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid
The XLogP value of 0.9201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid. The TPSA of 104.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid. Following Lipinski's Rule of Five, 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid has 1 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 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid?
The CAS number of 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid is 587012-01-9.
What is the molecular formula of 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid?
The molecular formula of 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid is C16H18N2O6.
What is the molecular weight of 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid?
The molecular weight of 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid is 334.12 g/mol.
Where can I buy 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid?
You can request a quote for 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-yl)-3-(4-methoxyphenyl)propanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.