C15H9BrN2O2S3
TL;DR: C15H9BrN2O2S3 (CAS 304861-08-3) is a chemical compound with molecular formula C15H9BrN2O2S3 and molecular weight 423.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]benzamide
Also Known As: 4-bromo-N-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide, (Z)-4-bromo-N-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)benzamide, (4-bromophenyl)-N-[4-oxo-5-(2-thienylmethylene)-2-thioxo(1,3-thiazolidin-3-yl) ]carboxamide
| Molecular Formula | C15H9BrN2O2S3 |
|---|---|
| Molecular Weight | 423.90 g/mol |
| LogP | 4.0568 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.90094 |
| Heavy Atoms | 23 |
| Complexity | 800.6393 |
Chemical Identifiers
| CAS Number | 304861-08-3 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C\2/C(=O)N(C(=S)S2)NC(=O)C3=CC=C(C=C3)Br |
Product Overview
C15H9BrN2O2S3 (CAS 304861-08-3), with molecular formula C15H9BrN2O2S3 and molecular weight 423.90 g/mol. IUPAC: 4-bromo-N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]benzamide.
Chemical Property Profile of C15H9BrN2O2S3
Property Insights of C15H9BrN2O2S3
The XLogP value of 4.0568 indicates that C15H9BrN2O2S3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, C15H9BrN2O2S3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C15H9BrN2O2S3 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 C15H9BrN2O2S3?
The CAS number of C15H9BrN2O2S3 is 304861-08-3.
What is the molecular formula of C15H9BrN2O2S3?
The molecular formula of C15H9BrN2O2S3 is C15H9BrN2O2S3.
What is the molecular weight of C15H9BrN2O2S3?
The molecular weight of C15H9BrN2O2S3 is 423.90 g/mol.
Where can I buy C15H9BrN2O2S3?
You can request a quote for C15H9BrN2O2S3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H9BrN2O2S3?
Yes, KEHONG BIO provides custom synthesis services for C15H9BrN2O2S3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.