F0590-0460
TL;DR: F0590-0460 (CAS 686749-13-3) is a chemical compound with molecular formula C31H26ClN3O4S2 and molecular weight 603.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfonyl-1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
Also Known As: F0590-0460, 2-((1-(2-chlorobenzyl)-1H-indol-3-yl)sulfonyl)-1-(5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone, 2-({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfonyl)-1-[5-(4-methoxyphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one, 2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfonyl-1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
| Molecular Formula | C31H26ClN3O4S2 |
|---|---|
| Molecular Weight | 603.11 g/mol |
| LogP | 6.5647 |
| Topological Polar Surface Area | 80.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 603.10535 |
| Heavy Atoms | 41 |
| Complexity | 1863.1886 |
Chemical Identifiers
| CAS Number | 686749-13-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CC(=NN2C(=O)CS(=O)(=O)C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5Cl)C6=CC=CS6 |
Product Overview
F0590-0460 (CAS 686749-13-3), with molecular formula C31H26ClN3O4S2 and molecular weight 603.11 g/mol. IUPAC: 2-[1-[(2-chlorophenyl)methyl]indol-3-yl]sulfonyl-1-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone.
Chemical Property Profile of F0590-0460
Property Insights of F0590-0460
The XLogP value of 6.5647 indicates that F0590-0460 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.97 Ų falls within the moderate polarity range, balancing permeability and solubility for F0590-0460. Following Lipinski's Rule of Five, F0590-0460 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0590-0460?
The CAS number of F0590-0460 is 686749-13-3.
What is the molecular formula of F0590-0460?
The molecular formula of F0590-0460 is C31H26ClN3O4S2.
What is the molecular weight of F0590-0460?
The molecular weight of F0590-0460 is 603.11 g/mol.
Where can I buy F0590-0460?
You can request a quote for F0590-0460 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0590-0460?
Yes, KEHONG BIO provides custom synthesis services for F0590-0460 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.