A3634/0154213
TL;DR: A3634/0154213 (CAS 697239-78-4) is a chemical compound with molecular formula C26H20FN3O6S and molecular weight 521.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-[3-(1,3-benzodioxol-5-ylmethyl)-2-(2-fluorophenyl)imino-4-oxo-1,3-thiazolidin-5-yl]acetyl]amino]benzoic acid
Also Known As: A3634/0154213, (E)-4-(2-(3-(BENZO[D][1,3]DIOXOL-5-YLMETHYL)-2-((2-FLUOROPHENYL)IMINO)-4-OXOTHIAZOLIDIN-5-YL)ACETAMIDO)BENZOIC ACID, 4-[({(2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-[(2-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetyl)amino]benzoic acid, 4-[(2-{3-(1,3-BENZODIOXOL-5-YLMETHYL)-2-[(2-FLUOROPHENYL)IMINO]-4-OXO-1,3-THIAZOLAN-5-YL}ACETYL)AMINO]BENZOIC ACID, 4-[[2-[3-(1,3-benzodioxol-5-ylmethyl)-2-(2-fluorophenyl)imino-4-oxo-1,3-thiazolidin-5-yl]acetyl]amino]benzoic acid
| Molecular Formula | C26H20FN3O6S |
|---|---|
| Molecular Weight | 521.11 g/mol |
| LogP | 4.4131 |
| Topological Polar Surface Area | 117.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.1057 |
| Heavy Atoms | 37 |
| Complexity | 1411.6759 |
Chemical Identifiers
| CAS Number | 697239-78-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CN3C(=O)C(SC3=NC4=CC=CC=C4F)CC(=O)NC5=CC=C(C=C5)C(=O)O |
Product Overview
A3634/0154213 (CAS 697239-78-4), with molecular formula C26H20FN3O6S and molecular weight 521.11 g/mol. IUPAC: 4-[[2-[3-(1,3-benzodioxol-5-ylmethyl)-2-(2-fluorophenyl)imino-4-oxo-1,3-thiazolidin-5-yl]acetyl]amino]benzoic acid.
Chemical Property Profile of A3634/0154213
Property Insights of A3634/0154213
The XLogP value of 4.4131 indicates that A3634/0154213 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.53 Ų falls within the moderate polarity range, balancing permeability and solubility for A3634/0154213. Following Lipinski's Rule of Five, A3634/0154213 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3634/0154213?
The CAS number of A3634/0154213 is 697239-78-4.
What is the molecular formula of A3634/0154213?
The molecular formula of A3634/0154213 is C26H20FN3O6S.
What is the molecular weight of A3634/0154213?
The molecular weight of A3634/0154213 is 521.11 g/mol.
Where can I buy A3634/0154213?
You can request a quote for A3634/0154213 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3634/0154213?
Yes, KEHONG BIO provides custom synthesis services for A3634/0154213 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.