![1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea structure](/static/products/7446/74466-87-8.webp)
1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea
TL;DR: 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea (CAS 74466-87-8) is a chemical compound with molecular formula C11H12F3N3S and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea
Also Known As: Maybridge1_000967, N-[(dimethylamino)methylene]-N'-[3-(trifluoromethyl)phenyl]thiourea, 3-[(DIMETHYLAMINO)METHYLIDENE]-1-[3-(TRIFLUOROMETHYL)PHENYL]THIOUREA, 1-(dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea, 3-[(1E)-(dimethylamino)methylidene]-1-[3-(trifluoromethyl)phenyl]thiourea
| Molecular Formula | C11H12F3N3S |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 2.9921 |
| Topological Polar Surface Area | 27.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.0704 |
| Heavy Atoms | 18 |
| Complexity | 455.09183 |
Chemical Identifiers
| CAS Number | 74466-87-8 |
|---|---|
| SMILES | CN(C)C=NC(=S)NC1=CC=CC(=C1)C(F)(F)F |
Product Overview
1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea (CAS 74466-87-8), with molecular formula C11H12F3N3S and molecular weight 275.07 g/mol. IUPAC: 1-(dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea.
Chemical Property Profile of 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea
Property Insights of 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea
The XLogP value of 2.9921 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea. With a topological polar surface area (TPSA) of 27.63 Ų, 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea has 1 hydrogen bond donor(s) and 1 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-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea?
The CAS number of 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea is 74466-87-8.
What is the molecular formula of 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea?
The molecular formula of 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea is C11H12F3N3S.
What is the molecular weight of 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea?
The molecular weight of 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea is 275.07 g/mol.
Where can I buy 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea?
You can request a quote for 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Dimethylaminomethylidene)-3-[3-(trifluoromethyl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.