2K-639S
TL;DR: 2K-639S (CAS 338774-87-1) is a chemical compound with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-diethylphenyl)-3-methyl-2,4-dioxo-1H-pyrimidine-6-carboxamide
Also Known As: 2K-639S, N-(2,6-diethylphenyl)-6-hydroxy-1-methyl-2-oxo-1,2-dihydro-4-pyrimidinecarboxamide, N-(2,6-diethylphenyl)-6-hydroxy-1-methyl-2-oxo-1,2-dihydropyrimidine-4-carboxamide, N-(2,6-diethylphenyl)-3-methyl-2,4-dioxo-1H-pyrimidine-6-carboxamide, N-(2,6-diethylphenyl)-1-methyl-2,6-dioxo-3H-pyrimidine-4-carboxamide
| Molecular Formula | C16H19N3O3 |
|---|---|
| Molecular Weight | 301.14 g/mol |
| LogP | 1.4507 |
| Topological Polar Surface Area | 83.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.14264 |
| Heavy Atoms | 22 |
| Complexity | 764.6162 |
Chemical Identifiers
| CAS Number | 338774-87-1 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC(=O)N(C(=O)N2)C |
Product Overview
2K-639S (CAS 338774-87-1), with molecular formula C16H19N3O3 and molecular weight 301.14 g/mol. IUPAC: N-(2,6-diethylphenyl)-3-methyl-2,4-dioxo-1H-pyrimidine-6-carboxamide.
Chemical Property Profile of 2K-639S
Property Insights of 2K-639S
The XLogP value of 1.4507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2K-639S. The TPSA of 83.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 2K-639S. Following Lipinski's Rule of Five, 2K-639S has 2 hydrogen bond donor(s) and 3 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 2K-639S?
The CAS number of 2K-639S is 338774-87-1.
What is the molecular formula of 2K-639S?
The molecular formula of 2K-639S is C16H19N3O3.
What is the molecular weight of 2K-639S?
The molecular weight of 2K-639S is 301.14 g/mol.
Where can I buy 2K-639S?
You can request a quote for 2K-639S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2K-639S?
Yes, KEHONG BIO provides custom synthesis services for 2K-639S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.