BAS 01258930
TL;DR: BAS 01258930 (CAS 306324-22-1) is a chemical compound with molecular formula C21H17NO5S2 and molecular weight 427.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid
Also Known As: BAS 01258930, BIM-0035174.P001, AE-641/12753360, F0393-0259, (Z)-2-(5-(4-(methoxycarbonyl)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-3-phenylpropanoic acid
| Molecular Formula | C21H17NO5S2 |
|---|---|
| Molecular Weight | 427.05 g/mol |
| LogP | 3.3703 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.0548 |
| Heavy Atoms | 29 |
| Complexity | 985.89087 |
Chemical Identifiers
| CAS Number | 306324-22-1 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)C(CC3=CC=CC=C3)C(=O)O |
Product Overview
BAS 01258930 (CAS 306324-22-1), with molecular formula C21H17NO5S2 and molecular weight 427.05 g/mol. IUPAC: 2-[(5Z)-5-[(4-methoxycarbonylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid.
Chemical Property Profile of BAS 01258930
Property Insights of BAS 01258930
The XLogP value of 3.3703 indicates that BAS 01258930 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01258930. Following Lipinski's Rule of Five, BAS 01258930 has 1 hydrogen bond donor(s) and 6 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 01258930?
The CAS number of BAS 01258930 is 306324-22-1.
What is the molecular formula of BAS 01258930?
The molecular formula of BAS 01258930 is C21H17NO5S2.
What is the molecular weight of BAS 01258930?
The molecular weight of BAS 01258930 is 427.05 g/mol.
Where can I buy BAS 01258930?
You can request a quote for BAS 01258930 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01258930?
Yes, KEHONG BIO provides custom synthesis services for BAS 01258930 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.