BIM-0042202.P001
TL;DR: BIM-0042202.P001 (CAS 306279-84-5) is a chemical compound with molecular formula C12H9N3O5S2 and molecular weight 339.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide
Also Known As: BIM-0042202.P001, (E)-N-(5-(4-hydroxy-3-nitrobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetamide, N-[(5E)-5-(4-hydroxy-3-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide, N-[5-(4-hydroxy-3-nitrobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetamide, N-{5-[(4-hydroxy-3-nitrophenyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl} acetamide
| Molecular Formula | C12H9N3O5S2 |
|---|---|
| Molecular Weight | 339.00 g/mol |
| LogP | 1.5527 |
| Topological Polar Surface Area | 112.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.99835 |
| Heavy Atoms | 22 |
| Complexity | 731.472 |
Chemical Identifiers
| CAS Number | 306279-84-5 |
|---|---|
| SMILES | CC(=O)NN1C(=O)/C(=C\C2=CC(=C(C=C2)O)[N+](=O)[O-])/SC1=S |
Product Overview
BIM-0042202.P001 (CAS 306279-84-5), with molecular formula C12H9N3O5S2 and molecular weight 339.00 g/mol. IUPAC: N-[(5E)-5-[(4-hydroxy-3-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of BIM-0042202.P001
Property Insights of BIM-0042202.P001
The XLogP value of 1.5527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0042202.P001. The TPSA of 112.78 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0042202.P001. Following Lipinski's Rule of Five, BIM-0042202.P001 has 2 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-0042202.P001?
The CAS number of BIM-0042202.P001 is 306279-84-5.
What is the molecular formula of BIM-0042202.P001?
The molecular formula of BIM-0042202.P001 is C12H9N3O5S2.
What is the molecular weight of BIM-0042202.P001?
The molecular weight of BIM-0042202.P001 is 339.00 g/mol.
Where can I buy BIM-0042202.P001?
You can request a quote for BIM-0042202.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042202.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042202.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.