BAS 00851261
TL;DR: BAS 00851261 (CAS 332040-87-6) is a chemical compound with molecular formula C22H22N4O3S3 and molecular weight 486.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[3-ethyl-5-(1-ethyl-6-methylquinolin-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide
Also Known As: BAS 00851261, N-[5-[3-Ethyl-5-(1-ethyl-6-methyl-2(1H)-quinolinylidene)-4-oxo-2-thiazolidinylidene]-4-oxo-2-thioxo-3-thiazolidinyl]acetamide, N-[5-[3-ethyl-5-(1-ethyl-6-methylquinolin-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide
| Molecular Formula | C22H22N4O3S3 |
|---|---|
| Molecular Weight | 486.09 g/mol |
| LogP | 1.91922 |
| Topological Polar Surface Area | 74.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 486.08542 |
| Heavy Atoms | 32 |
| Complexity | 1369.6677 |
Chemical Identifiers
| CAS Number | 332040-87-6 |
|---|---|
| SMILES | CCN1C2=C(C=CC1=C3C(=O)N(C(=C4C(=O)N(C(=S)S4)NC(=O)C)S3)CC)C=C(C=C2)C |
Product Overview
BAS 00851261 (CAS 332040-87-6), with molecular formula C22H22N4O3S3 and molecular weight 486.09 g/mol. IUPAC: N-[5-[3-ethyl-5-(1-ethyl-6-methylquinolin-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of BAS 00851261
Property Insights of BAS 00851261
The XLogP value of 1.91922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00851261. The TPSA of 74.65 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00851261. Following Lipinski's Rule of Five, BAS 00851261 has 1 hydrogen bond donor(s) and 7 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 BAS 00851261?
The CAS number of BAS 00851261 is 332040-87-6.
What is the molecular formula of BAS 00851261?
The molecular formula of BAS 00851261 is C22H22N4O3S3.
What is the molecular weight of BAS 00851261?
The molecular weight of BAS 00851261 is 486.09 g/mol.
Where can I buy BAS 00851261?
You can request a quote for BAS 00851261 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00851261?
Yes, KEHONG BIO provides custom synthesis services for BAS 00851261 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.