1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea
TL;DR: 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea (CAS 452950-47-9) is a chemical compound with molecular formula C17H17F2N3O3S2 and molecular weight 413.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea
Also Known As: 1-(2,4-difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea, 1-(2,4-difluorophenyl)-3-[4-(morpholin-4-ylsulfonyl)phenyl]thiourea, 4-{[4-({[(2,4-difluorophenyl)amino]thioxomethyl}amino)phenyl]sulfonyl}morpholi ne
| Molecular Formula | C17H17F2N3O3S2 |
|---|---|
| Molecular Weight | 413.07 g/mol |
| LogP | 2.7946 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.06793 |
| Heavy Atoms | 27 |
| Complexity | 930.9399 |
Chemical Identifiers
| CAS Number | 452950-47-9 |
|---|---|
| SMILES | C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=C(C=C(C=C3)F)F |
Product Overview
1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea (CAS 452950-47-9), with molecular formula C17H17F2N3O3S2 and molecular weight 413.07 g/mol. IUPAC: 1-(2,4-difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea.
Chemical Property Profile of 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea
Property Insights of 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea
The XLogP value of 2.7946 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea. Following Lipinski's Rule of Five, 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea has 2 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 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea?
The CAS number of 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea is 452950-47-9.
What is the molecular formula of 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea?
The molecular formula of 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea is C17H17F2N3O3S2.
What is the molecular weight of 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea?
The molecular weight of 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea is 413.07 g/mol.
Where can I buy 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea?
You can request a quote for 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Difluorophenyl)-3-(4-morpholin-4-ylsulfonylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.