CBKinase1_004246
TL;DR: CBKinase1_004246 (CAS 713096-00-5) is a chemical compound with molecular formula C18H16ClN3O2S and molecular weight 373.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[(6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: CBKinase1_004246, CBKinase1_016646, BRD-A49467286-001-01-4, N-(4-chlorophenyl)-2-[(6-oxo-4-phenyl-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]acetamide, N-(4-chlorophenyl)-2-[(6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]acetamide
| Molecular Formula | C18H16ClN3O2S |
|---|---|
| Molecular Weight | 373.07 g/mol |
| LogP | 3.6289 |
| Topological Polar Surface Area | 70.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.0652 |
| Heavy Atoms | 25 |
| Complexity | 793.7283 |
Chemical Identifiers
| CAS Number | 713096-00-5 |
|---|---|
| SMILES | C1C(N=C(NC1=O)SCC(=O)NC2=CC=C(C=C2)Cl)C3=CC=CC=C3 |
Product Overview
CBKinase1_004246 (CAS 713096-00-5), with molecular formula C18H16ClN3O2S and molecular weight 373.07 g/mol. IUPAC: N-(4-chlorophenyl)-2-[(6-oxo-4-phenyl-4,5-dihydro-1H-pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_004246
Property Insights of CBKinase1_004246
The XLogP value of 3.6289 indicates that CBKinase1_004246 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.56 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004246. Following Lipinski's Rule of Five, CBKinase1_004246 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 CBKinase1_004246?
The CAS number of CBKinase1_004246 is 713096-00-5.
What is the molecular formula of CBKinase1_004246?
The molecular formula of CBKinase1_004246 is C18H16ClN3O2S.
What is the molecular weight of CBKinase1_004246?
The molecular weight of CBKinase1_004246 is 373.07 g/mol.
Where can I buy CBKinase1_004246?
You can request a quote for CBKinase1_004246 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004246?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004246 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.