![1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea structure](/static/products/4776/4776-26-5.webp)
1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea
TL;DR: 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea (CAS 4776-26-5) is a chemical compound with molecular formula C10H12F3N3S and molecular weight 263.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea
Also Known As: 1-(dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea, 2,2-dimethyl-N-[3-(trifluoromethyl)phenyl]hydrazinecarbothioamide, 2,2-Dimethyl-N-[3-(trifluoromethyl)phenyl]hydrazine-1-carbothioamide, N1-[3-(trifluoromethyl)phenyl]-2,2-dimethylhydrazine-1-carbothioamide
| Molecular Formula | C10H12F3N3S |
|---|---|
| Molecular Weight | 263.07 g/mol |
| LogP | 2.4684 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.0704 |
| Heavy Atoms | 17 |
| Complexity | 404.02774 |
Chemical Identifiers
| CAS Number | 4776-26-5 |
|---|---|
| SMILES | CN(C)NC(=S)NC1=CC=CC(=C1)C(F)(F)F |
Product Overview
1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea (CAS 4776-26-5), with molecular formula C10H12F3N3S and molecular weight 263.07 g/mol. IUPAC: 1-(dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea.
Chemical Property Profile of 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea
Property Insights of 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea
The XLogP value of 2.4684 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea. With a topological polar surface area (TPSA) of 27.3 Ų, 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea has 2 hydrogen bond donor(s) and 2 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-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea?
The CAS number of 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea is 4776-26-5.
What is the molecular formula of 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea?
The molecular formula of 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea is C10H12F3N3S.
What is the molecular weight of 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea?
The molecular weight of 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea is 263.07 g/mol.
Where can I buy 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea?
You can request a quote for 1-(Dimethylamino)-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-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(Dimethylamino)-3-[3-(trifluoromethyl)phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.