BAS 00502741
TL;DR: BAS 00502741 (CAS 300378-20-5) is a chemical compound with molecular formula C22H20N2O5S2 and molecular weight 456.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
Also Known As: BAS 00502741, (Z)-2-(4-(5-(4-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)butanamido)benzoic acid, F0385-0440, 2-{4-[(5Z)-5-[(4-METHOXYPHENYL)METHYLIDENE]-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]BUTANAMIDO}BENZOIC ACID, 2-[4-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid
| Molecular Formula | C22H20N2O5S2 |
|---|---|
| Molecular Weight | 456.08 g/mol |
| LogP | 4.0135 |
| Topological Polar Surface Area | 95.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.08136 |
| Heavy Atoms | 31 |
| Complexity | 1050.1217 |
Chemical Identifiers
| CAS Number | 300378-20-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=CC=C3C(=O)O |
Product Overview
BAS 00502741 (CAS 300378-20-5), with molecular formula C22H20N2O5S2 and molecular weight 456.08 g/mol. IUPAC: 2-[4-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]benzoic acid.
Chemical Property Profile of BAS 00502741
Property Insights of BAS 00502741
The XLogP value of 4.0135 indicates that BAS 00502741 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00502741. Following Lipinski's Rule of Five, BAS 00502741 has 2 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 00502741?
The CAS number of BAS 00502741 is 300378-20-5.
What is the molecular formula of BAS 00502741?
The molecular formula of BAS 00502741 is C22H20N2O5S2.
What is the molecular weight of BAS 00502741?
The molecular weight of BAS 00502741 is 456.08 g/mol.
Where can I buy BAS 00502741?
You can request a quote for BAS 00502741 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00502741?
Yes, KEHONG BIO provides custom synthesis services for BAS 00502741 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.