F0545-0387
TL;DR: F0545-0387 (CAS 681276-06-2) is a chemical compound with molecular formula C34H30BrN3OS and molecular weight 607.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(4-bromophenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanylethanone
Also Known As: F0545-0387, 1-(3-(4-bromophenyl)-5-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)-2-((1-(3-methylbenzyl)-1H-indol-3-yl)thio)ethanone, 1-[3-(4-bromophenyl)-5-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-({1-[(3-methylphenyl)methyl]-1H-indol-3-yl}sulfanyl)ethan-1-one, 1-[5-(4-bromophenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanylethanone
| Molecular Formula | C34H30BrN3OS |
|---|---|
| Molecular Weight | 607.13 g/mol |
| LogP | 8.53894 |
| Topological Polar Surface Area | 37.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 607.1293 |
| Heavy Atoms | 40 |
| Complexity | 1706.087 |
Chemical Identifiers
| CAS Number | 681276-06-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=CC(=C5)C)C6=CC=C(C=C6)Br |
Product Overview
F0545-0387 (CAS 681276-06-2), with molecular formula C34H30BrN3OS and molecular weight 607.13 g/mol. IUPAC: 1-[5-(4-bromophenyl)-3-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanylethanone.
Chemical Property Profile of F0545-0387
Property Insights of F0545-0387
The XLogP value of 8.53894 indicates that F0545-0387 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.6 Ų, F0545-0387 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0545-0387 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0545-0387?
The CAS number of F0545-0387 is 681276-06-2.
What is the molecular formula of F0545-0387?
The molecular formula of F0545-0387 is C34H30BrN3OS.
What is the molecular weight of F0545-0387?
The molecular weight of F0545-0387 is 607.13 g/mol.
Where can I buy F0545-0387?
You can request a quote for F0545-0387 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0545-0387?
Yes, KEHONG BIO provides custom synthesis services for F0545-0387 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.