9L-565S
TL;DR: 9L-565S (CAS 478261-62-0) is a chemical compound with molecular formula C19H16Cl3N3S2 and molecular weight 454.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-chlorophenyl)sulfanylmethyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]-N-methylpyrimidin-4-amine
Also Known As: 9L-565S, N-{6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(3,4-dichlorobenzyl)sulfanyl]-4-pyrimidinyl}-N-methylamine, 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]-N-methylpyrimidin-4-amine, 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-N-methylpyrimidin-4-amine
| Molecular Formula | C19H16Cl3N3S2 |
|---|---|
| Molecular Weight | 454.99 g/mol |
| LogP | 7.0631 |
| Topological Polar Surface Area | 37.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 454.98514 |
| Heavy Atoms | 27 |
| Complexity | 920.5735 |
Chemical Identifiers
| CAS Number | 478261-62-0 |
|---|---|
| SMILES | CNC1=NC(=NC(=C1)CSC2=CC=C(C=C2)Cl)SCC3=CC(=C(C=C3)Cl)Cl |
Product Overview
9L-565S (CAS 478261-62-0), with molecular formula C19H16Cl3N3S2 and molecular weight 454.99 g/mol. IUPAC: 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(3,4-dichlorophenyl)methylsulfanyl]-N-methylpyrimidin-4-amine.
Chemical Property Profile of 9L-565S
Property Insights of 9L-565S
The XLogP value of 7.0631 indicates that 9L-565S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.81 Ų, 9L-565S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9L-565S has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9L-565S?
The CAS number of 9L-565S is 478261-62-0.
What is the molecular formula of 9L-565S?
The molecular formula of 9L-565S is C19H16Cl3N3S2.
What is the molecular weight of 9L-565S?
The molecular weight of 9L-565S is 454.99 g/mol.
Where can I buy 9L-565S?
You can request a quote for 9L-565S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9L-565S?
Yes, KEHONG BIO provides custom synthesis services for 9L-565S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.