4-(2,4-Difluorophenyl)-3-thiosemicarbazide
TL;DR: 4-(2,4-Difluorophenyl)-3-thiosemicarbazide (CAS 774554-52-8) is a chemical compound with molecular formula C7H7F2N3S and molecular weight 203.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-3-(2,4-difluorophenyl)thiourea
Also Known As: N-(2,4-difluorophenyl)hydrazinecarbothioamide, 4-(2,4-Difluorophenyl)-3-thiosemicarbazide, 1-amino-3-(2,4-difluorophenyl)thiourea, 3-amino-1-(2,4-difluorophenyl)thiourea, Hydrazinecarbothioamide, N-(2,4-difluorophenyl)-
| Molecular Formula | C7H7F2N3S |
|---|---|
| Molecular Weight | 203.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 82.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.03287 |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 774554-52-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)F)NC(=S)NN |
| InChIKey | RNPFEUCQZZXGCF-UHFFFAOYSA-N |
Product Overview
4-(2,4-Difluorophenyl)-3-thiosemicarbazide (CAS 774554-52-8), with molecular formula C7H7F2N3S and molecular weight 203.03 g/mol. IUPAC: 1-amino-3-(2,4-difluorophenyl)thiourea.
Chemical Property Profile of 4-(2,4-Difluorophenyl)-3-thiosemicarbazide
Property Insights of 4-(2,4-Difluorophenyl)-3-thiosemicarbazide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2,4-Difluorophenyl)-3-thiosemicarbazide. The TPSA of 82.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,4-Difluorophenyl)-3-thiosemicarbazide. Following Lipinski's Rule of Five, 4-(2,4-Difluorophenyl)-3-thiosemicarbazide has 3 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 4-(2,4-Difluorophenyl)-3-thiosemicarbazide?
The CAS number of 4-(2,4-Difluorophenyl)-3-thiosemicarbazide is 774554-52-8.
What is the molecular formula of 4-(2,4-Difluorophenyl)-3-thiosemicarbazide?
The molecular formula of 4-(2,4-Difluorophenyl)-3-thiosemicarbazide is C7H7F2N3S.
What is the molecular weight of 4-(2,4-Difluorophenyl)-3-thiosemicarbazide?
The molecular weight of 4-(2,4-Difluorophenyl)-3-thiosemicarbazide is 203.03 g/mol.
Where can I buy 4-(2,4-Difluorophenyl)-3-thiosemicarbazide?
You can request a quote for 4-(2,4-Difluorophenyl)-3-thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2,4-Difluorophenyl)-3-thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2,4-Difluorophenyl)-3-thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.