1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide
TL;DR: 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide (CAS 5193-82-8) is a chemical compound with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide
Also Known As: 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide, 1-Butyl-4-hydroxy-2-oxo-N-phenyl-1,2-dihydropyrimidine-5-sulfonamide
| Molecular Formula | C14H17N3O4S |
|---|---|
| Molecular Weight | 323.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 323.09396 |
| Heavy Atoms | 22 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 5193-82-8 |
|---|---|
| SMILES | CCCCN1C=C(C(=O)NC1=O)S(=O)(=O)NC2=CC=CC=C2 |
| InChIKey | WXAMAAGREJHXQF-UHFFFAOYSA-N |
Product Overview
1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide (CAS 5193-82-8), with molecular formula C14H17N3O4S and molecular weight 323.09 g/mol. IUPAC: 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide.
Chemical Property Profile of 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide
Property Insights of 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide. Following Lipinski's Rule of Five, 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide 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 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide?
The CAS number of 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide is 5193-82-8.
What is the molecular formula of 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide?
The molecular formula of 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide is C14H17N3O4S.
What is the molecular weight of 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide?
The molecular weight of 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide is 323.09 g/mol.
Where can I buy 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide?
You can request a quote for 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 1-butyl-2,4-dioxo-N-phenylpyrimidine-5-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.