RefChem:437177
TL;DR: RefChem:437177 (CAS 618076-89-4) is a chemical compound with molecular formula C26H33BrN2O4S2 and molecular weight 580.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-[(5Z)-5-(5-bromo-1-butyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid
Also Known As: 11-(5-(5-Bromo-1-butyl-2-oxoindolin-3-ylidene)-4-oxo-2-thioxothiazolidin-3-yl)undecanoic acid, 11-[(5Z)-5-(5-bromo-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoic acid, 11-((5Z)-5-(5-BROMO-1-BUTYL-2-OXO-1,2-DIHYDRO-3H-INDOL-3-YLIDENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL)UNDECANOIC ACID, 11-[(5Z)-5-(5-bromo-1-butyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid, 645-833-6
| Molecular Formula | C26H33BrN2O4S2 |
|---|---|
| Molecular Weight | 580.11 g/mol |
| LogP | 6.7627 |
| Topological Polar Surface Area | 77.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 580.1065 |
| Heavy Atoms | 35 |
| Complexity | 1011.066 |
Chemical Identifiers
| CAS Number | 618076-89-4 |
|---|---|
| SMILES | CCCCN1C2=C(C=C(C=C2)Br)/C(=C/3\C(=O)N(C(=S)S3)CCCCCCCCCCC(=O)O)/C1=O |
Product Overview
RefChem:437177 (CAS 618076-89-4), with molecular formula C26H33BrN2O4S2 and molecular weight 580.11 g/mol. IUPAC: 11-[(5Z)-5-(5-bromo-1-butyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid.
Chemical Property Profile of RefChem:437177
Property Insights of RefChem:437177
The XLogP value of 6.7627 indicates that RefChem:437177 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.92 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:437177. Following Lipinski's Rule of Five, RefChem:437177 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 RefChem:437177?
The CAS number of RefChem:437177 is 618076-89-4.
What is the molecular formula of RefChem:437177?
The molecular formula of RefChem:437177 is C26H33BrN2O4S2.
What is the molecular weight of RefChem:437177?
The molecular weight of RefChem:437177 is 580.11 g/mol.
Where can I buy RefChem:437177?
You can request a quote for RefChem:437177 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:437177?
Yes, KEHONG BIO provides custom synthesis services for RefChem:437177 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.