![3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea structure](/static/products/7219/721910-08-3.webp)
3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea
TL;DR: 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea (CAS 721910-08-3) is a chemical compound with molecular formula C8H9F2N3S2 and molecular weight 249.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-[4-(difluoromethylsulfanyl)phenyl]thiourea
Also Known As: 3-amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea, 1-amino-3-[4-(difluoromethylsulfanyl)phenyl]thiourea, N-{4-[(difluoromethyl)thio]phenylhydrazinecarbothioamide, 3-amino-1-(4-[(difluoromethyl)sulfanyl]phenyl)thiourea, N-(4-[(Difluoromethyl)thio]phenylhydrazinecarbothioamide
| Molecular Formula | C8H9F2N3S2 |
|---|---|
| Molecular Weight | 249.02 g/mol |
| LogP | 2.1614 |
| Topological Polar Surface Area | 50.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.0206 |
| Heavy Atoms | 15 |
| Complexity | 329.1636 |
Chemical Identifiers
| CAS Number | 721910-08-3 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=S)NN)SC(F)F |
Product Overview
3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea (CAS 721910-08-3), with molecular formula C8H9F2N3S2 and molecular weight 249.02 g/mol. IUPAC: 1-amino-3-[4-(difluoromethylsulfanyl)phenyl]thiourea.
Chemical Property Profile of 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea
Property Insights of 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea
The XLogP value of 2.1614 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea. With a topological polar surface area (TPSA) of 50.08 Ų, 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea has 3 hydrogen bond donor(s) and 3 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 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea?
The CAS number of 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea is 721910-08-3.
What is the molecular formula of 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea?
The molecular formula of 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea is C8H9F2N3S2.
What is the molecular weight of 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea?
The molecular weight of 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea is 249.02 g/mol.
Where can I buy 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea?
You can request a quote for 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-1-{4-[(difluoromethyl)sulfanyl]phenyl}thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.