5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide
TL;DR: 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide (CAS 904509-20-2) is a chemical compound with molecular formula C15H17BrN4O5 and molecular weight 412.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N-[3-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methylamino]-3-oxopropyl]furan-2-carboxamide
Also Known As: 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide, 5-bromo-N-(3-{[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]amino}-3-oxopropyl)furan-2-carboxamide, 5-bromo-N-[3-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methylamino]-3-oxopropyl]furan-2-carboxamide
| Molecular Formula | C15H17BrN4O5 |
|---|---|
| Molecular Weight | 412.04 g/mol |
| LogP | -0.1242 |
| Topological Polar Surface Area | 115.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.03824 |
| Heavy Atoms | 25 |
| Complexity | 911.37604 |
Chemical Identifiers
| CAS Number | 904509-20-2 |
|---|---|
| SMILES | CN1C(=CC(=O)N(C1=O)C)CNC(=O)CCNC(=O)C2=CC=C(O2)Br |
Product Overview
5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide (CAS 904509-20-2), with molecular formula C15H17BrN4O5 and molecular weight 412.04 g/mol. IUPAC: 5-bromo-N-[3-[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methylamino]-3-oxopropyl]furan-2-carboxamide.
Chemical Property Profile of 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide
Property Insights of 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide
The XLogP value of -0.1242 indicates that 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide. Following Lipinski's Rule of Five, 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide 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 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide?
The CAS number of 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide is 904509-20-2.
What is the molecular formula of 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide?
The molecular formula of 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide is C15H17BrN4O5.
What is the molecular weight of 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide?
The molecular weight of 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide is 412.04 g/mol.
Where can I buy 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide?
You can request a quote for 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-N-(3-(((1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)amino)-3-oxopropyl)furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.