RefChem:401740
TL;DR: RefChem:401740 (CAS 617696-15-8) is a chemical compound with molecular formula C14H11BrN2O2S2 and molecular weight 381.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-(5-bromo-2-oxo-1-propylindol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: IDI1_011081, AB00674339-01, 5-(5-Bromo-2-oxo-1-propylindolin-3-ylidene)-2-thioxothiazolidin-4-one, (3Z)-5-bromo-3-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1-propyl-1,3-dihydro-2H-indol-2-one, (5Z)-5-(5-bromo-2-oxo-1-propylindol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C14H11BrN2O2S2 |
|---|---|
| Molecular Weight | 381.94 g/mol |
| LogP | 3.0647 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 381.94452 |
| Heavy Atoms | 21 |
| Complexity | 714.9256 |
Chemical Identifiers
| CAS Number | 617696-15-8 |
|---|---|
| SMILES | CCCN1C2=C(C=C(C=C2)Br)/C(=C/3\C(=O)NC(=S)S3)/C1=O |
Product Overview
RefChem:401740 (CAS 617696-15-8), with molecular formula C14H11BrN2O2S2 and molecular weight 381.94 g/mol. IUPAC: (5Z)-5-(5-bromo-2-oxo-1-propylindol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:401740
Property Insights of RefChem:401740
The XLogP value of 3.0647 indicates that RefChem:401740 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, RefChem:401740 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:401740 has 1 hydrogen bond donor(s) and 4 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:401740?
The CAS number of RefChem:401740 is 617696-15-8.
What is the molecular formula of RefChem:401740?
The molecular formula of RefChem:401740 is C14H11BrN2O2S2.
What is the molecular weight of RefChem:401740?
The molecular weight of RefChem:401740 is 381.94 g/mol.
Where can I buy RefChem:401740?
You can request a quote for RefChem:401740 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:401740?
Yes, KEHONG BIO provides custom synthesis services for RefChem:401740 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.