Leukadherin 1
TL;DR: Leukadherin 1 (CAS 2055362-72-4) is a chemical compound with molecular formula C22H15NO4S2 and molecular weight 421.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid
Also Known As: Leukadherin 1, (Z)-Leukadherin-1, Leukadherin-1?, ADH503 free acid, GB-1275 free acid
| Molecular Formula | C22H15NO4S2 |
|---|---|
| Molecular Weight | 421.04 g/mol |
| LogP | 5.0462 |
| Topological Polar Surface Area | 70.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.04425 |
| Heavy Atoms | 29 |
| Complexity | 1117.2288 |
Chemical Identifiers
| CAS Number | 2055362-72-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)/C(=C/C3=CC=C(O3)C4=CC=C(C=C4)C(=O)O)/SC2=S |
Product Overview
Leukadherin 1 (CAS 2055362-72-4), with molecular formula C22H15NO4S2 and molecular weight 421.04 g/mol. IUPAC: 4-[5-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of Leukadherin 1
Property Insights of Leukadherin 1
The XLogP value of 5.0462 indicates that Leukadherin 1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Leukadherin 1. Following Lipinski's Rule of Five, Leukadherin 1 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Leukadherin 1?
The CAS number of Leukadherin 1 is 2055362-72-4.
What is the molecular formula of Leukadherin 1?
The molecular formula of Leukadherin 1 is C22H15NO4S2.
What is the molecular weight of Leukadherin 1?
The molecular weight of Leukadherin 1 is 421.04 g/mol.
Where can I buy Leukadherin 1?
You can request a quote for Leukadherin 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Leukadherin 1?
Yes, KEHONG BIO provides custom synthesis services for Leukadherin 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.