RefChem:322376
TL;DR: RefChem:322376 (CAS 55477-32-2) is a chemical compound with molecular formula C18H23Cl2N5OS and molecular weight 427.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-6-(4-methylpiperazin-4-ium-1-yl)-5-methylsulfanylpyrimidin-2-yl]-N-methylbenzamide chloride
Also Known As: Benzamide, N-(4-chloro-6-(4-methyl-1-piperazinyl)-5-(methylthio)-2-pyrimidinyl)-N-methyl-, monohydrochloride, 2-(N-Methyl-N-benzoyl)amino-4-N-methyl-piperazino-6-chloro-5-methylthio-pyrimidine HCl, N-[4-chloro-6-(4-methylpiperazin-4-ium-1-yl)-5-methylsulfanylpyrimidin-2-yl]-N-methylbenzamide chloride, BENZAMIDE, N-(4-CHLORO-6-(4-METHYL-1-PIPERAZINYL)-5-(METHYLTHIO)-2-PYRIMIDINYL)-, RefChem:322376
| Molecular Formula | C18H23Cl2N5OS |
|---|---|
| Molecular Weight | 427.10 g/mol |
| LogP | -1.53 |
| Topological Polar Surface Area | 79.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.10004 |
| Heavy Atoms | 27 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 55477-32-2 |
|---|---|
| SMILES | C[NH+]1CCN(CC1)C2=C(C(=NC(=N2)N(C)C(=O)C3=CC=CC=C3)Cl)SC.[Cl-] |
| InChIKey | WXNZHNBICYJCMQ-UHFFFAOYSA-N |
Product Overview
RefChem:322376 (CAS 55477-32-2), with molecular formula C18H23Cl2N5OS and molecular weight 427.10 g/mol. IUPAC: N-[4-chloro-6-(4-methylpiperazin-4-ium-1-yl)-5-methylsulfanylpyrimidin-2-yl]-N-methylbenzamide chloride.
Chemical Property Profile of RefChem:322376
Property Insights of RefChem:322376
The XLogP value of -1.53 indicates that RefChem:322376 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:322376. Following Lipinski's Rule of Five, RefChem:322376 has 1 hydrogen bond donor(s) and 6 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 RefChem:322376?
The CAS number of RefChem:322376 is 55477-32-2.
What is the molecular formula of RefChem:322376?
The molecular formula of RefChem:322376 is C18H23Cl2N5OS.
What is the molecular weight of RefChem:322376?
The molecular weight of RefChem:322376 is 427.10 g/mol.
Where can I buy RefChem:322376?
You can request a quote for RefChem:322376 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:322376?
Yes, KEHONG BIO provides custom synthesis services for RefChem:322376 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.