Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate
TL;DR: Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate (CAS 304877-41-6) is a chemical compound with molecular formula C22H20N2O7 and molecular weight 424.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5-(2-methoxy-2-oxoethyl)-2,4,6-trioxo-1,3-diphenyl-1,3-diazinan-5-yl]acetate
Also Known As: dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate, methyl 2-[5-(2-methoxy-2-oxoethyl)-2,4,6-trioxo-1,3-diphenyl-1,3-diazinan-5-yl]acetate, Methyl 2-[5-(methoxycarbonylmethyl)-2,4,6-trioxo-1,3-diphenyl-1,3-diazinan-5-yl]acetate, methyl 2-{5-[(methoxycarbonyl)methyl]-2,4,6-trioxo-1,3-diphenyl-1,3,5-trihydro pyrimidin-5-yl}acetate
| Molecular Formula | C22H20N2O7 |
|---|---|
| Molecular Weight | 424.13 g/mol |
| LogP | 2.299 |
| Topological Polar Surface Area | 110.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.12704 |
| Heavy Atoms | 31 |
| Complexity | 939.1696 |
Chemical Identifiers
| CAS Number | 304877-41-6 |
|---|---|
| SMILES | COC(=O)CC1(C(=O)N(C(=O)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)OC |
Product Overview
Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate (CAS 304877-41-6), with molecular formula C22H20N2O7 and molecular weight 424.13 g/mol. IUPAC: methyl 2-[5-(2-methoxy-2-oxoethyl)-2,4,6-trioxo-1,3-diphenyl-1,3-diazinan-5-yl]acetate.
Chemical Property Profile of Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate
Property Insights of Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate
The XLogP value of 2.299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate. The TPSA of 110.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate. Following Lipinski's Rule of Five, Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate has 0 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 Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate?
The CAS number of Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate is 304877-41-6.
What is the molecular formula of Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate?
The molecular formula of Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate is C22H20N2O7.
What is the molecular weight of Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate?
The molecular weight of Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate is 424.13 g/mol.
Where can I buy Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate?
You can request a quote for Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2,2'-(2,4,6-trioxo-1,3-diphenylhexahydropyrimidine-5,5-diyl)diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.