11L-524S
TL;DR: 11L-524S (CAS 303985-07-1) is a chemical compound with molecular formula C25H16F3N3S2 and molecular weight 479.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfanyl-4-phenyl-6-[3-(trifluoromethyl)phenyl]sulfanylpyrimidine-5-carbonitrile
Also Known As: 11L-524S, 2-(benzylsulfanyl)-4-phenyl-6-{[3-(trifluoromethyl)phenyl]sulfanyl}-5-pyrimidinecarbonitrile, 2-(benzylsulfanyl)-4-phenyl-6-{[3-(trifluoromethyl)phenyl]sulfanyl}pyrimidine-5-carbonitrile, 2-benzylsulfanyl-4-phenyl-6-[3-(trifluoromethyl)phenyl]sulfanylpyrimidine-5-carbonitrile, 2-benzylsulfanyl-4-phenyl-6-[3-(trifluoromethyl)phenyl]sulfanyl-pyrimidine-5-carbonitrile
| Molecular Formula | C25H16F3N3S2 |
|---|---|
| Molecular Weight | 479.07 g/mol |
| LogP | 7.47758 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.07376 |
| Heavy Atoms | 33 |
| Complexity | 1288.0343 |
Chemical Identifiers
| CAS Number | 303985-07-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC(=C(C(=N2)SC3=CC=CC(=C3)C(F)(F)F)C#N)C4=CC=CC=C4 |
Product Overview
11L-524S (CAS 303985-07-1), with molecular formula C25H16F3N3S2 and molecular weight 479.07 g/mol. IUPAC: 2-benzylsulfanyl-4-phenyl-6-[3-(trifluoromethyl)phenyl]sulfanylpyrimidine-5-carbonitrile.
Chemical Property Profile of 11L-524S
Property Insights of 11L-524S
The XLogP value of 7.47758 indicates that 11L-524S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.57 Ų, 11L-524S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11L-524S has 0 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 11L-524S?
The CAS number of 11L-524S is 303985-07-1.
What is the molecular formula of 11L-524S?
The molecular formula of 11L-524S is C25H16F3N3S2.
What is the molecular weight of 11L-524S?
The molecular weight of 11L-524S is 479.07 g/mol.
Where can I buy 11L-524S?
You can request a quote for 11L-524S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11L-524S?
Yes, KEHONG BIO provides custom synthesis services for 11L-524S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.