BIM-0042145.P001
TL;DR: BIM-0042145.P001 (CAS 306279-89-0) is a chemical compound with molecular formula C13H9N3O6S2 and molecular weight 366.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5Z)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide
Also Known As: BIM-0042145.P001, N-[(5Z)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide, (Z)-N-(5-((6-nitrobenzo[d][1,3]dioxol-5-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)acetamide, N-[(5Z)-5-[(6-NITRO-2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]ACETAMIDE, N-{(5Z)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetamide
| Molecular Formula | C13H9N3O6S2 |
|---|---|
| Molecular Weight | 366.99 g/mol |
| LogP | 1.5758 |
| Topological Polar Surface Area | 111.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.9933 |
| Heavy Atoms | 24 |
| Complexity | 822.1702 |
Chemical Identifiers
| CAS Number | 306279-89-0 |
|---|---|
| SMILES | CC(=O)NN1C(=O)/C(=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)/SC1=S |
Product Overview
BIM-0042145.P001 (CAS 306279-89-0), with molecular formula C13H9N3O6S2 and molecular weight 366.99 g/mol. IUPAC: N-[(5Z)-5-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of BIM-0042145.P001
Property Insights of BIM-0042145.P001
The XLogP value of 1.5758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0042145.P001. The TPSA of 111.01 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0042145.P001. Following Lipinski's Rule of Five, BIM-0042145.P001 has 1 hydrogen bond donor(s) and 8 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-0042145.P001?
The CAS number of BIM-0042145.P001 is 306279-89-0.
What is the molecular formula of BIM-0042145.P001?
The molecular formula of BIM-0042145.P001 is C13H9N3O6S2.
What is the molecular weight of BIM-0042145.P001?
The molecular weight of BIM-0042145.P001 is 366.99 g/mol.
Where can I buy BIM-0042145.P001?
You can request a quote for BIM-0042145.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042145.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042145.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.