2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine
TL;DR: 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine (CAS 338954-53-3) is a chemical compound with molecular formula C15H17Cl2N3OS and molecular weight 357.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dichlorophenyl)methylsulfanyl]-5-methoxy-N-propan-2-ylpyrimidin-4-amine
Also Known As: 5J-303S, 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine, 2-[(3,4-dichlorophenyl)methylsulfanyl]-5-methoxy-N-propan-2-ylpyrimidin-4-amine, 2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-5-methoxy-N-(propan-2-yl)pyrimidin-4-amine, 2-[(3,4-dichlorobenzyl)sulfanyl]-N-isopropyl-5-methoxy-4-pyrimidinamine
| Molecular Formula | C15H17Cl2N3OS |
|---|---|
| Molecular Weight | 357.05 g/mol |
| LogP | 4.9046 |
| Topological Polar Surface Area | 47.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.04694 |
| Heavy Atoms | 22 |
| Complexity | 652.6799 |
Chemical Identifiers
| CAS Number | 338954-53-3 |
|---|---|
| SMILES | CC(C)NC1=NC(=NC=C1OC)SCC2=CC(=C(C=C2)Cl)Cl |
Product Overview
2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine (CAS 338954-53-3), with molecular formula C15H17Cl2N3OS and molecular weight 357.05 g/mol. IUPAC: 2-[(3,4-dichlorophenyl)methylsulfanyl]-5-methoxy-N-propan-2-ylpyrimidin-4-amine.
Chemical Property Profile of 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine
Property Insights of 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine
The XLogP value of 4.9046 indicates that 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.04 Ų, 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine 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 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine?
The CAS number of 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine is 338954-53-3.
What is the molecular formula of 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine?
The molecular formula of 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine is C15H17Cl2N3OS.
What is the molecular weight of 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine?
The molecular weight of 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine is 357.05 g/mol.
Where can I buy 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine?
You can request a quote for 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine?
Yes, KEHONG BIO provides custom synthesis services for 2-((3,4-Dichlorobenzyl)sulfanyl)-N-isopropyl-5-methoxy-4-pyrimidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.