BAS 02056960
TL;DR: BAS 02056960 (CAS 314751-58-1) is a chemical compound with molecular formula C17H19NO6S2 and molecular weight 397.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(5Z)-4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl]propanoate
Also Known As: BAS 02056960, methyl 3-[(5Z)-4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl]propanoate, (Z)-methyl 3-(4-oxo-2-thioxo-5-(3,4,5-trimethoxybenzylidene)thiazolidin-3-yl)propanoate, F0768-0001, methyl 3-[(5Z)-4-oxo-2-thioxo-5-(3,4,5-trimethoxybenzylidene)-1,3-thiazolidin-3-yl]propanoate
| Molecular Formula | C17H19NO6S2 |
|---|---|
| Molecular Weight | 397.07 g/mol |
| LogP | 2.4767 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.06537 |
| Heavy Atoms | 26 |
| Complexity | 736.6152 |
Chemical Identifiers
| CAS Number | 314751-58-1 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C\2/C(=O)N(C(=S)S2)CCC(=O)OC |
Product Overview
BAS 02056960 (CAS 314751-58-1), with molecular formula C17H19NO6S2 and molecular weight 397.07 g/mol. IUPAC: methyl 3-[(5Z)-4-oxo-2-sulfanylidene-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidin-3-yl]propanoate.
Chemical Property Profile of BAS 02056960
Property Insights of BAS 02056960
The XLogP value of 2.4767 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02056960. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02056960. Following Lipinski's Rule of Five, BAS 02056960 has 0 hydrogen bond donor(s) and 8 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 02056960?
The CAS number of BAS 02056960 is 314751-58-1.
What is the molecular formula of BAS 02056960?
The molecular formula of BAS 02056960 is C17H19NO6S2.
What is the molecular weight of BAS 02056960?
The molecular weight of BAS 02056960 is 397.07 g/mol.
Where can I buy BAS 02056960?
You can request a quote for BAS 02056960 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02056960?
Yes, KEHONG BIO provides custom synthesis services for BAS 02056960 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.