VU0508521-1
TL;DR: VU0508521-1 (CAS 786676-96-8) is a chemical compound with molecular formula C20H14Cl2FN3O2S and molecular weight 449.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-cyano-2-[5-[(2,4-dichlorophenyl)methyl]-3-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-N-methylacetamide
Also Known As: VU0508521-1, (Z)-2-cyano-2-(5-(2,4-dichlorobenzyl)-3-(4-fluorophenyl)-4-oxothiazolidin-2-ylidene)-N-methylacetamide, F3077-1081, (2Z)-2-cyano-2-[5-[(2,4-dichlorophenyl)methyl]-3-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-N-methylacetamide, 2-CYANO-2-[(2Z)-5-[(2,4-DICHLOROPHENYL)METHYL]-3-(4-FLUOROPHENYL)-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE]-N-METHYLACETAMIDE
| Molecular Formula | C20H14Cl2FN3O2S |
|---|---|
| Molecular Weight | 449.02 g/mol |
| LogP | 4.30478 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 449.01678 |
| Heavy Atoms | 29 |
| Complexity | 1050.6821 |
Chemical Identifiers
| CAS Number | 786676-96-8 |
|---|---|
| SMILES | CNC(=O)/C(=C\1/N(C(=O)C(S1)CC2=C(C=C(C=C2)Cl)Cl)C3=CC=C(C=C3)F)/C#N |
Product Overview
VU0508521-1 (CAS 786676-96-8), with molecular formula C20H14Cl2FN3O2S and molecular weight 449.02 g/mol. IUPAC: (2Z)-2-cyano-2-[5-[(2,4-dichlorophenyl)methyl]-3-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-N-methylacetamide.
Chemical Property Profile of VU0508521-1
Property Insights of VU0508521-1
The XLogP value of 4.30478 indicates that VU0508521-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0508521-1. Following Lipinski's Rule of Five, VU0508521-1 has 1 hydrogen bond donor(s) and 4 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 VU0508521-1?
The CAS number of VU0508521-1 is 786676-96-8.
What is the molecular formula of VU0508521-1?
The molecular formula of VU0508521-1 is C20H14Cl2FN3O2S.
What is the molecular weight of VU0508521-1?
The molecular weight of VU0508521-1 is 449.02 g/mol.
Where can I buy VU0508521-1?
You can request a quote for VU0508521-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0508521-1?
Yes, KEHONG BIO provides custom synthesis services for VU0508521-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.