1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-
TL;DR: 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- (CAS 55255-85-1) is a chemical compound with molecular formula C13H11BrN2O4 and molecular weight 337.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-4-methyl-2,6-dioxo-3-phenylpyrimidin-1-yl)acetic acid
Also Known As: 5-24-07-00044 (Beilstein Handbook Reference), 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-, 5-Brom-3-carboxymethyl-1-phenyl-6-methyl-uracil, (5-bromo-4-methyl-2,6-dioxo-3-phenyl-3,6-dihydropyrimidin-1(2h)-yl)acetic acid, 3,6-Dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-1(2H)-pyrimidineacetic acid
| Molecular Formula | C13H11BrN2O4 |
|---|---|
| Molecular Weight | 337.99 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 77.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.99023 |
| Heavy Atoms | 20 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 55255-85-1 |
|---|---|
| SMILES | CC1=C(C(=O)N(C(=O)N1C2=CC=CC=C2)CC(=O)O)Br |
| InChIKey | YGJBTNBMZIQBMT-UHFFFAOYSA-N |
Product Overview
1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- (CAS 55255-85-1), with molecular formula C13H11BrN2O4 and molecular weight 337.99 g/mol. IUPAC: 2-(5-bromo-4-methyl-2,6-dioxo-3-phenylpyrimidin-1-yl)acetic acid.
Chemical Property Profile of 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-
Property Insights of 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-. The TPSA of 77.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-. Following Lipinski's Rule of Five, 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- has 1 hydrogen bond donor(s) and 4 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 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-?
The CAS number of 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- is 55255-85-1.
What is the molecular formula of 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-?
The molecular formula of 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- is C13H11BrN2O4.
What is the molecular weight of 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-?
The molecular weight of 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- is 337.99 g/mol.
Where can I buy 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-?
You can request a quote for 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1(2H)-Pyrimidineacetic acid, 3,6-dihydro-5-bromo-2,6-dioxo-4-methyl-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.