2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide
TL;DR: 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide (CAS 868216-27-7) is a chemical compound with molecular formula C11H7ClN4O5 and molecular weight 310.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2,4-dioxo-1H-pyrimidin-6-yl)-5-nitrobenzamide
Also Known As: 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide, 2-chloro-N-(2,4-dioxo-1H-pyrimidin-6-yl)-5-nitrobenzamide, F1803-0028
| Molecular Formula | C11H7ClN4O5 |
|---|---|
| Molecular Weight | 310.01 g/mol |
| LogP | 0.8771 |
| Topological Polar Surface Area | 137.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 310.0105 |
| Heavy Atoms | 21 |
| Complexity | 812.7426 |
Chemical Identifiers
| CAS Number | 868216-27-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C(=O)NC2=CC(=O)NC(=O)N2)Cl |
Product Overview
2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide (CAS 868216-27-7), with molecular formula C11H7ClN4O5 and molecular weight 310.01 g/mol. IUPAC: 2-chloro-N-(2,4-dioxo-1H-pyrimidin-6-yl)-5-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide
Property Insights of 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide
The XLogP value of 0.8771 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide. The TPSA of 137.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide has 3 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-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide?
The CAS number of 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide is 868216-27-7.
What is the molecular formula of 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide?
The molecular formula of 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide is C11H7ClN4O5.
What is the molecular weight of 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide?
The molecular weight of 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide is 310.01 g/mol.
Where can I buy 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide?
You can request a quote for 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.