F0784-0419
TL;DR: F0784-0419 (CAS 397276-25-4) is a chemical compound with molecular formula C27H26BrN3O2S and molecular weight 535.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenyl)-2-[[5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone
Also Known As: F0784-0419, 1-(4-bromophenyl)-2-[(5-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one, 1-(4-bromophenyl)-2-((5-((2-isopropyl-5-methylphenoxy)methyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)ethanone, 1-(4-bromophenyl)-2-[[5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone, 1-(4-BROMOPHENYL)-2-({5-[(2-ISOPROPYL-5-METHYLPHENOXY)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL}SULFANYL)ETHANONE
| Molecular Formula | C27H26BrN3O2S |
|---|---|
| Molecular Weight | 535.09 g/mol |
| LogP | 7.01562 |
| Topological Polar Surface Area | 57.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 535.0929 |
| Heavy Atoms | 34 |
| Complexity | 1271.0421 |
Chemical Identifiers
| CAS Number | 397276-25-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=CC=C(C=C4)Br |
Product Overview
F0784-0419 (CAS 397276-25-4), with molecular formula C27H26BrN3O2S and molecular weight 535.09 g/mol. IUPAC: 1-(4-bromophenyl)-2-[[5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanone.
Chemical Property Profile of F0784-0419
Property Insights of F0784-0419
The XLogP value of 7.01562 indicates that F0784-0419 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.01 Ų, F0784-0419 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0784-0419 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 F0784-0419?
The CAS number of F0784-0419 is 397276-25-4.
What is the molecular formula of F0784-0419?
The molecular formula of F0784-0419 is C27H26BrN3O2S.
What is the molecular weight of F0784-0419?
The molecular weight of F0784-0419 is 535.09 g/mol.
Where can I buy F0784-0419?
You can request a quote for F0784-0419 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0784-0419?
Yes, KEHONG BIO provides custom synthesis services for F0784-0419 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.