BIM-0027780.P001
TL;DR: BIM-0027780.P001 (CAS 301308-58-7) is a chemical compound with molecular formula C18H13BrN2O4S2 and molecular weight 463.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Also Known As: BIM-0027780.P001, AE-641/11948121, 4-bromo-N-[(5Z)-5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide, (Z)-4-bromo-N-(5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzamide, 4-bromo-N-[5-(4-hydroxy-3-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
| Molecular Formula | C18H13BrN2O4S2 |
|---|---|
| Molecular Weight | 463.95 g/mol |
| LogP | 3.7095 |
| Topological Polar Surface Area | 78.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 463.95 |
| Heavy Atoms | 27 |
| Complexity | 960.33405 |
Chemical Identifiers
| CAS Number | 301308-58-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)NC(=O)C3=CC=C(C=C3)Br)O |
Product Overview
BIM-0027780.P001 (CAS 301308-58-7), with molecular formula C18H13BrN2O4S2 and molecular weight 463.95 g/mol. IUPAC: 4-bromo-N-[(5Z)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide.
Chemical Property Profile of BIM-0027780.P001
Property Insights of BIM-0027780.P001
The XLogP value of 3.7095 indicates that BIM-0027780.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.87 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0027780.P001. Following Lipinski's Rule of Five, BIM-0027780.P001 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 BIM-0027780.P001?
The CAS number of BIM-0027780.P001 is 301308-58-7.
What is the molecular formula of BIM-0027780.P001?
The molecular formula of BIM-0027780.P001 is C18H13BrN2O4S2.
What is the molecular weight of BIM-0027780.P001?
The molecular weight of BIM-0027780.P001 is 463.95 g/mol.
Where can I buy BIM-0027780.P001?
You can request a quote for BIM-0027780.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0027780.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0027780.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.