3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea
TL;DR: 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea (CAS 328068-37-7) is a chemical compound with molecular formula C19H19ClFN3OS and molecular weight 391.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4H-1,3-thiazol-2-yl)-1-(2-methylphenyl)urea
Also Known As: 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea, 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4H-1,3-thiazol-2-yl)-1-(2-methylphenyl)urea, 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydro-1,3-thiazol-2-yl)-1-(2-methylphenyl)urea, N-(5,5-dimethyl(1,3-thiazolin-2-yl))[(3-chloro-4-fluorophenyl)amino]-N-(2-meth ylphenyl)carboxamide
| Molecular Formula | C19H19ClFN3OS |
|---|---|
| Molecular Weight | 391.09 g/mol |
| LogP | 5.70742 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 391.09213 |
| Heavy Atoms | 26 |
| Complexity | 884.838 |
Chemical Identifiers
| CAS Number | 328068-37-7 |
|---|---|
| SMILES | CC1=CC=CC=C1N(C2=NCC(S2)(C)C)C(=O)NC3=CC(=C(C=C3)F)Cl |
Product Overview
3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea (CAS 328068-37-7), with molecular formula C19H19ClFN3OS and molecular weight 391.09 g/mol. IUPAC: 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4H-1,3-thiazol-2-yl)-1-(2-methylphenyl)urea.
Chemical Property Profile of 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea
Property Insights of 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea
The XLogP value of 5.70742 indicates that 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea has 1 hydrogen bond donor(s) and 3 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-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea?
The CAS number of 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea is 328068-37-7.
What is the molecular formula of 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea?
The molecular formula of 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea is C19H19ClFN3OS.
What is the molecular weight of 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea?
The molecular weight of 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea is 391.09 g/mol.
Where can I buy 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea?
You can request a quote for 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-chloro-4-fluorophenyl)-1-(5,5-dimethyl-4,5-dihydrothiazol-2-yl)-1-(o-tolyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.