ChemDiv3_002573
TL;DR: ChemDiv3_002573 (CAS 428843-06-5) is a chemical compound with molecular formula C19H14FNO5S and molecular weight 387.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(Z)-[3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetic acid
Also Known As: ChemDiv3_002573, BRD-K37199849-001-01-5, (4-{(Z)-[3-(4-fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid, (4-{[3-(4-fluorobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid, (Z)-2-(4-((3-(4-fluorobenzyl)-2,4-dioxothiazolidin-5-ylidene)methyl)phenoxy)acetic acid
| Molecular Formula | C19H14FNO5S |
|---|---|
| Molecular Weight | 387.06 g/mol |
| LogP | 3.5256 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.05768 |
| Heavy Atoms | 27 |
| Complexity | 908.7022 |
Chemical Identifiers
| CAS Number | 428843-06-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C(=O)/C(=C/C3=CC=C(C=C3)OCC(=O)O)/SC2=O)F |
Product Overview
ChemDiv3_002573 (CAS 428843-06-5), with molecular formula C19H14FNO5S and molecular weight 387.06 g/mol. IUPAC: 2-[4-[(Z)-[3-[(4-fluorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetic acid.
Chemical Property Profile of ChemDiv3_002573
Property Insights of ChemDiv3_002573
The XLogP value of 3.5256 indicates that ChemDiv3_002573 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_002573. Following Lipinski's Rule of Five, ChemDiv3_002573 has 1 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 ChemDiv3_002573?
The CAS number of ChemDiv3_002573 is 428843-06-5.
What is the molecular formula of ChemDiv3_002573?
The molecular formula of ChemDiv3_002573 is C19H14FNO5S.
What is the molecular weight of ChemDiv3_002573?
The molecular weight of ChemDiv3_002573 is 387.06 g/mol.
Where can I buy ChemDiv3_002573?
You can request a quote for ChemDiv3_002573 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_002573?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_002573 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.