BAS 00664241
TL;DR: BAS 00664241 (CAS 302824-24-4) is a chemical compound with molecular formula C14H13NO3S2 and molecular weight 307.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5Z)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
Also Known As: BAS 00664241, 3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid, 3-[(5Z)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid, (Z)-3-(5-(4-methylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid, 3-[5-(4-Methyl-benzylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-propionic acid
| Molecular Formula | C14H13NO3S2 |
|---|---|
| Molecular Weight | 307.03 g/mol |
| LogP | 2.67092 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.0337 |
| Heavy Atoms | 20 |
| Complexity | 592.9415 |
Chemical Identifiers
| CAS Number | 302824-24-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCC(=O)O |
Product Overview
BAS 00664241 (CAS 302824-24-4), with molecular formula C14H13NO3S2 and molecular weight 307.03 g/mol. IUPAC: 3-[(5Z)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid.
Chemical Property Profile of BAS 00664241
Property Insights of BAS 00664241
The XLogP value of 2.67092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00664241. With a topological polar surface area (TPSA) of 57.61 Ų, BAS 00664241 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00664241 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 BAS 00664241?
The CAS number of BAS 00664241 is 302824-24-4.
What is the molecular formula of BAS 00664241?
The molecular formula of BAS 00664241 is C14H13NO3S2.
What is the molecular weight of BAS 00664241?
The molecular weight of BAS 00664241 is 307.03 g/mol.
Where can I buy BAS 00664241?
You can request a quote for BAS 00664241 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00664241?
Yes, KEHONG BIO provides custom synthesis services for BAS 00664241 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.