BIM-0049940.P001
TL;DR: BIM-0049940.P001 (CAS 403829-39-0) is a chemical compound with molecular formula C19H13ClN2O4S2 and molecular weight 432.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]amino]benzoic acid
Also Known As: BIM-0049940.P001, AB00105531-01, (Z)-2-(2-(5-(2-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetamido)benzoic acid, F1004-0049, 2-{2-[(5Z)-5-[(2-CHLOROPHENYL)METHYLIDENE]-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]ACETAMIDO}BENZOIC ACID
| Molecular Formula | C19H13ClN2O4S2 |
|---|---|
| Molecular Weight | 432.00 g/mol |
| LogP | 3.8781 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.00052 |
| Heavy Atoms | 28 |
| Complexity | 1022.49817 |
Chemical Identifiers
| CAS Number | 403829-39-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=C\2/C(=O)N(C(=S)S2)CC(=O)NC3=CC=CC=C3C(=O)O)Cl |
Product Overview
BIM-0049940.P001 (CAS 403829-39-0), with molecular formula C19H13ClN2O4S2 and molecular weight 432.00 g/mol. IUPAC: 2-[[2-[(5Z)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]amino]benzoic acid.
Chemical Property Profile of BIM-0049940.P001
Property Insights of BIM-0049940.P001
The XLogP value of 3.8781 indicates that BIM-0049940.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0049940.P001. Following Lipinski's Rule of Five, BIM-0049940.P001 has 2 hydrogen bond donor(s) and 5 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-0049940.P001?
The CAS number of BIM-0049940.P001 is 403829-39-0.
What is the molecular formula of BIM-0049940.P001?
The molecular formula of BIM-0049940.P001 is C19H13ClN2O4S2.
What is the molecular weight of BIM-0049940.P001?
The molecular weight of BIM-0049940.P001 is 432.00 g/mol.
Where can I buy BIM-0049940.P001?
You can request a quote for BIM-0049940.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0049940.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0049940.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.