3K-633S
TL;DR: 3K-633S (CAS 861212-23-9) is a chemical compound with molecular formula C17H10Cl3N3O3 and molecular weight 408.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
Also Known As: 3K-633S, 1-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-6-hydroxy-2-oxo-1,2-dihydro-4-pyrimidinecarboxamide, 1-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-6-hydroxy-2-oxo-1,2-dihydropyrimidine-4-carboxamide, 3-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-2,4-dioxo-1H-pyrimidine-6-carboxamide, 1-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-2,6-dioxo-3H-pyrimidine-4-carboxamide
| Molecular Formula | C17H10Cl3N3O3 |
|---|---|
| Molecular Weight | 408.98 g/mol |
| LogP | 3.7383 |
| Topological Polar Surface Area | 83.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.97876 |
| Heavy Atoms | 26 |
| Complexity | 1073.4664 |
Chemical Identifiers
| CAS Number | 861212-23-9 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=O)C=C(NC2=O)C(=O)NC3=CC(=C(C=C3)Cl)Cl)Cl |
Product Overview
3K-633S (CAS 861212-23-9), with molecular formula C17H10Cl3N3O3 and molecular weight 408.98 g/mol. IUPAC: 3-(4-chlorophenyl)-N-(3,4-dichlorophenyl)-2,4-dioxo-1H-pyrimidine-6-carboxamide.
Chemical Property Profile of 3K-633S
Property Insights of 3K-633S
The XLogP value of 3.7383 indicates that 3K-633S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 3K-633S. Following Lipinski's Rule of Five, 3K-633S 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 3K-633S?
The CAS number of 3K-633S is 861212-23-9.
What is the molecular formula of 3K-633S?
The molecular formula of 3K-633S is C17H10Cl3N3O3.
What is the molecular weight of 3K-633S?
The molecular weight of 3K-633S is 408.98 g/mol.
Where can I buy 3K-633S?
You can request a quote for 3K-633S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3K-633S?
Yes, KEHONG BIO provides custom synthesis services for 3K-633S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.