AH-487/40935391
TL;DR: AH-487/40935391 (CAS 444063-13-2) is a chemical compound with molecular formula C26H22BrN3O3S and molecular weight 535.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(5E)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid
Also Known As: AH-487/40935391, 4-(((2Z,5E)-5-(3-bromo-4-(dimethylamino)benzylidene)-4-oxo-2-(phenylimino)thiazolidin-3-yl)methyl)benzoic acid, 4-[[(5E)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid
| Molecular Formula | C26H22BrN3O3S |
|---|---|
| Molecular Weight | 535.06 g/mol |
| LogP | 6.0175 |
| Topological Polar Surface Area | 73.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 535.0565 |
| Heavy Atoms | 34 |
| Complexity | 1288.4028 |
Chemical Identifiers
| CAS Number | 444063-13-2 |
|---|---|
| SMILES | CN(C)C1=C(C=C(C=C1)/C=C/2\C(=O)N(C(=NC3=CC=CC=C3)S2)CC4=CC=C(C=C4)C(=O)O)Br |
Product Overview
AH-487/40935391 (CAS 444063-13-2), with molecular formula C26H22BrN3O3S and molecular weight 535.06 g/mol. IUPAC: 4-[[(5E)-5-[[3-bromo-4-(dimethylamino)phenyl]methylidene]-4-oxo-2-phenylimino-1,3-thiazolidin-3-yl]methyl]benzoic acid.
Chemical Property Profile of AH-487/40935391
Property Insights of AH-487/40935391
The XLogP value of 6.0175 indicates that AH-487/40935391 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.21 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/40935391. Following Lipinski's Rule of Five, AH-487/40935391 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 AH-487/40935391?
The CAS number of AH-487/40935391 is 444063-13-2.
What is the molecular formula of AH-487/40935391?
The molecular formula of AH-487/40935391 is C26H22BrN3O3S.
What is the molecular weight of AH-487/40935391?
The molecular weight of AH-487/40935391 is 535.06 g/mol.
Where can I buy AH-487/40935391?
You can request a quote for AH-487/40935391 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/40935391?
Yes, KEHONG BIO provides custom synthesis services for AH-487/40935391 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.