![4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride structure](/static/products/1629/16290-71-4.webp)
4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride
TL;DR: 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride (CAS 16290-71-4) is a chemical compound with molecular formula C11H9ClN2O4S and molecular weight 300.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride
Also Known As: 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride, 4-((2,6-Dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl)benzene-1-sulfonyl chloride, 4-[(2,6-Dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)methyl]benzene-1-sulfonyl chloride, Benzenesulfonylchloride, 4-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methyl]-, Benzenesulfonylchloride,4-[(1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinyl)methyl]
| Molecular Formula | C11H9ClN2O4S |
|---|---|
| Molecular Weight | 300.00 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.99716 |
| Heavy Atoms | 19 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 16290-71-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CC2=CC(=O)NC(=O)N2)S(=O)(=O)Cl |
| InChIKey | QTCUVHXENORRFJ-UHFFFAOYSA-N |
Product Overview
4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride (CAS 16290-71-4), with molecular formula C11H9ClN2O4S and molecular weight 300.00 g/mol. IUPAC: 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride.
Chemical Property Profile of 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride
Property Insights of 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride. Following Lipinski's Rule of Five, 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride has 2 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 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride?
The CAS number of 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride is 16290-71-4.
What is the molecular formula of 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride?
The molecular formula of 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride is C11H9ClN2O4S.
What is the molecular weight of 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride?
The molecular weight of 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride is 300.00 g/mol.
Where can I buy 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride?
You can request a quote for 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]benzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.