5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine
TL;DR: 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine (CAS 352659-01-9) is a chemical compound with molecular formula C17H22ClN3OS and molecular weight 351.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-butoxyphenyl)methyl]-6-chloro-N-methyl-2-methylsulfanylpyrimidin-4-amine
Also Known As: AJ-292/14556141, 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)-4-pyrimidinamine, 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine, 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylthio)pyrimidin-4-amine, 5-[(4-butoxyphenyl)methyl]-6-chloro-N-methyl-2-methylsulfanylpyrimidin-4-amine
| Molecular Formula | C17H22ClN3OS |
|---|---|
| Molecular Weight | 351.12 g/mol |
| LogP | 4.6633 |
| Topological Polar Surface Area | 47.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 351.11722 |
| Heavy Atoms | 23 |
| Complexity | 634.4808 |
Chemical Identifiers
| CAS Number | 352659-01-9 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)NC |
Product Overview
5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine (CAS 352659-01-9), with molecular formula C17H22ClN3OS and molecular weight 351.12 g/mol. IUPAC: 5-[(4-butoxyphenyl)methyl]-6-chloro-N-methyl-2-methylsulfanylpyrimidin-4-amine.
Chemical Property Profile of 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine
Property Insights of 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine
The XLogP value of 4.6633 indicates that 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.04 Ų, 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine has 1 hydrogen bond donor(s) and 5 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 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine?
The CAS number of 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine is 352659-01-9.
What is the molecular formula of 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine?
The molecular formula of 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine is C17H22ClN3OS.
What is the molecular weight of 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine?
The molecular weight of 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine is 351.12 g/mol.
Where can I buy 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine?
You can request a quote for 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-butoxybenzyl)-6-chloro-N-methyl-2-(methylsulfanyl)pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.