10L-549S
TL;DR: 10L-549S (CAS 341965-48-8) is a chemical compound with molecular formula C21H19ClFN3S2 and molecular weight 431.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(4-chlorophenyl)sulfanylmethyl]-2-[(4-fluorophenyl)methylsulfanyl]-N-prop-2-enylpyrimidin-4-amine
Also Known As: 10L-549S, N-allyl-6-{[(4-chlorophenyl)sulfanyl]methyl}-2-[(4-fluorobenzyl)sulfanyl]-4-pyrimidinamine, 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(4-fluorophenyl)methylsulfanyl]-N-prop-2-enylpyrimidin-4-amine, 6-{[(4-chlorophenyl)sulfanyl]methyl}-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(prop-2-en-1-yl)pyrimidin-4-amine
| Molecular Formula | C21H19ClFN3S2 |
|---|---|
| Molecular Weight | 431.07 g/mol |
| LogP | 6.4516 |
| Topological Polar Surface Area | 37.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 431.0693 |
| Heavy Atoms | 28 |
| Complexity | 850.1887 |
Chemical Identifiers
| CAS Number | 341965-48-8 |
|---|---|
| SMILES | C=CCNC1=NC(=NC(=C1)CSC2=CC=C(C=C2)Cl)SCC3=CC=C(C=C3)F |
Product Overview
10L-549S (CAS 341965-48-8), with molecular formula C21H19ClFN3S2 and molecular weight 431.07 g/mol. IUPAC: 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(4-fluorophenyl)methylsulfanyl]-N-prop-2-enylpyrimidin-4-amine.
Chemical Property Profile of 10L-549S
Property Insights of 10L-549S
The XLogP value of 6.4516 indicates that 10L-549S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.81 Ų, 10L-549S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10L-549S 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 10L-549S?
The CAS number of 10L-549S is 341965-48-8.
What is the molecular formula of 10L-549S?
The molecular formula of 10L-549S is C21H19ClFN3S2.
What is the molecular weight of 10L-549S?
The molecular weight of 10L-549S is 431.07 g/mol.
Where can I buy 10L-549S?
You can request a quote for 10L-549S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10L-549S?
Yes, KEHONG BIO provides custom synthesis services for 10L-549S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.