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4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine
TL;DR: 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine (CAS 6969-80-8) is a chemical compound with molecular formula C11H8Cl3N3S and molecular weight 318.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-6-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidin-2-amine
Also Known As: 4-chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine, 4-chloro-6-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidin-2-amine, 4-Chloro-6-((2,4-dichlorobenzyl)thio)pyrimidin-2-amine, 4-chloro-6-(2,4-dichloro-benzylsulfanyl)-pyrimidin-2-ylamine, 4-CHLORO-6-{[(2,4-DICHLOROPHENYL)METHYL]SULFANYL}PYRIMIDIN-2-AMINE
| Molecular Formula | C11H8Cl3N3S |
|---|---|
| Molecular Weight | 318.95 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.95044 |
| Heavy Atoms | 18 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 6969-80-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)CSC2=CC(=NC(=N2)N)Cl |
| InChIKey | LQHLTTKDALJKPJ-UHFFFAOYSA-N |
Product Overview
4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine (CAS 6969-80-8), with molecular formula C11H8Cl3N3S and molecular weight 318.95 g/mol. IUPAC: 4-chloro-6-[(2,4-dichlorophenyl)methylsulfanyl]pyrimidin-2-amine.
Chemical Property Profile of 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine
Property Insights of 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine
The XLogP value of 4.4 indicates that 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine. Following Lipinski's Rule of Five, 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine has 1 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 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine?
The CAS number of 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine is 6969-80-8.
What is the molecular formula of 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine?
The molecular formula of 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine is C11H8Cl3N3S.
What is the molecular weight of 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine?
The molecular weight of 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine is 318.95 g/mol.
Where can I buy 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine?
You can request a quote for 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-6-[(2,4-dichlorobenzyl)sulfanyl]pyrimidin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.