3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea
TL;DR: 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea (CAS 369605-25-4) is a chemical compound with molecular formula C20H21ClFN3O2S2 and molecular weight 453.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-1-[3-[2-(2-fluorophenyl)ethyl]-5,5-dimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxyurea
Also Known As: 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea, 3-(3-chlorophenyl)-1-[3-[2-(2-fluorophenyl)ethyl]-5,5-dimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxyurea, 3-(3-chlorophenyl)-1-{3-[2-(2-fluorophenyl)ethyl]-5,5-dimethyl-2-thioxo-1,3-thiazolidin-4-yl}-1-hydroxyurea
| Molecular Formula | C20H21ClFN3O2S2 |
|---|---|
| Molecular Weight | 453.07 g/mol |
| LogP | 5.3833 |
| Topological Polar Surface Area | 55.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.07477 |
| Heavy Atoms | 29 |
| Complexity | 928.10425 |
Chemical Identifiers
| CAS Number | 369605-25-4 |
|---|---|
| SMILES | CC1(C(N(C(=S)S1)CCC2=CC=CC=C2F)N(C(=O)NC3=CC(=CC=C3)Cl)O)C |
Product Overview
3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea (CAS 369605-25-4), with molecular formula C20H21ClFN3O2S2 and molecular weight 453.07 g/mol. IUPAC: 3-(3-chlorophenyl)-1-[3-[2-(2-fluorophenyl)ethyl]-5,5-dimethyl-2-sulfanylidene-1,3-thiazolidin-4-yl]-1-hydroxyurea.
Chemical Property Profile of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea
Property Insights of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea
The XLogP value of 5.3833 indicates that 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.81 Ų, 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea?
The CAS number of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea is 369605-25-4.
What is the molecular formula of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea?
The molecular formula of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea is C20H21ClFN3O2S2.
What is the molecular weight of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea?
The molecular weight of 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea is 453.07 g/mol.
Where can I buy 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea?
You can request a quote for 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-chlorophenyl)-1-(3-(2-fluorophenethyl)-5,5-dimethyl-2-thioxothiazolidin-4-yl)-1-hydroxyurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.