RefChem:509662
TL;DR: RefChem:509662 (CAS 618076-95-2) is a chemical compound with molecular formula C19H19BrN2O4S2 and molecular weight 482.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5Z)-5-(5-bromo-1-butyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid
Also Known As: 4-(5-(5-Bromo-1-butyl-2-oxoindolin-3-ylidene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid, 4-[(5Z)-5-(5-bromo-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid, 4-(5-(5-Bromo-1-butyl-2-oxoindolin-3-ylidene)-4-oxo-2-thioxothiazolidin-3-yl)butanoicacid, 4-((5Z)-5-(5-Bromo-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-YL)butanoic acid, 4-[(5Z)-5-(5-bromo-1-butyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid
| Molecular Formula | C19H19BrN2O4S2 |
|---|---|
| Molecular Weight | 482.00 g/mol |
| LogP | 4.032 |
| Topological Polar Surface Area | 77.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 481.99695 |
| Heavy Atoms | 28 |
| Complexity | 899.91986 |
Chemical Identifiers
| CAS Number | 618076-95-2 |
|---|---|
| SMILES | CCCCN1C2=C(C=C(C=C2)Br)/C(=C/3\C(=O)N(C(=S)S3)CCCC(=O)O)/C1=O |
Product Overview
RefChem:509662 (CAS 618076-95-2), with molecular formula C19H19BrN2O4S2 and molecular weight 482.00 g/mol. IUPAC: 4-[(5Z)-5-(5-bromo-1-butyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid.
Chemical Property Profile of RefChem:509662
Property Insights of RefChem:509662
The XLogP value of 4.032 indicates that RefChem:509662 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:509662. Following Lipinski's Rule of Five, RefChem:509662 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:509662?
The CAS number of RefChem:509662 is 618076-95-2.
What is the molecular formula of RefChem:509662?
The molecular formula of RefChem:509662 is C19H19BrN2O4S2.
What is the molecular weight of RefChem:509662?
The molecular weight of RefChem:509662 is 482.00 g/mol.
Where can I buy RefChem:509662?
You can request a quote for RefChem:509662 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:509662?
Yes, KEHONG BIO provides custom synthesis services for RefChem:509662 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.