BIM-0001436.P001
TL;DR: BIM-0001436.P001 (CAS 16942-79-3) is a chemical compound with molecular formula C16H15NO7S2 and molecular weight 397.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioic acid
Also Known As: BIM-0001436.P001, AB00102936-01, 2-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioic acid, (Z)-2-(5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)pentanedioic acid, 2-[(5Z)-5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioic acid
| Molecular Formula | C16H15NO7S2 |
|---|---|
| Molecular Weight | 397.03 g/mol |
| LogP | 1.92 |
| Topological Polar Surface Area | 124.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 397.029 |
| Heavy Atoms | 26 |
| Complexity | 805.788 |
Chemical Identifiers
| CAS Number | 16942-79-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)C(CCC(=O)O)C(=O)O)O |
Product Overview
BIM-0001436.P001 (CAS 16942-79-3), with molecular formula C16H15NO7S2 and molecular weight 397.03 g/mol. IUPAC: 2-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioic acid.
Chemical Property Profile of BIM-0001436.P001
Property Insights of BIM-0001436.P001
The XLogP value of 1.92 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0001436.P001. The TPSA of 124.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0001436.P001. Following Lipinski's Rule of Five, BIM-0001436.P001 has 3 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 BIM-0001436.P001?
The CAS number of BIM-0001436.P001 is 16942-79-3.
What is the molecular formula of BIM-0001436.P001?
The molecular formula of BIM-0001436.P001 is C16H15NO7S2.
What is the molecular weight of BIM-0001436.P001?
The molecular weight of BIM-0001436.P001 is 397.03 g/mol.
Where can I buy BIM-0001436.P001?
You can request a quote for BIM-0001436.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0001436.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0001436.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.