N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide
TL;DR: N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide (CAS 404-55-7) is a chemical compound with molecular formula C8H9FN4S2 and molecular weight 244.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(carbamothioylamino)-3-(4-fluorophenyl)thiourea
Also Known As: BAS 01176010, N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide, 1-(carbamothioylamino)-3-(4-fluorophenyl)thiourea, {[(4-fluorophenyl)carbamothioyl]amino}thiourea, AN-329/40396897
| Molecular Formula | C8H9FN4S2 |
|---|---|
| Molecular Weight | 244.03 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.02527 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 404-55-7 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=S)NNC(=S)N)F |
| InChIKey | IUBRKXPNPOHVIY-UHFFFAOYSA-N |
Product Overview
N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide (CAS 404-55-7), with molecular formula C8H9FN4S2 and molecular weight 244.03 g/mol. IUPAC: 1-(carbamothioylamino)-3-(4-fluorophenyl)thiourea.
Chemical Property Profile of N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide
Property Insights of N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide. Following Lipinski's Rule of Five, N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide has 4 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 N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide?
The CAS number of N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide is 404-55-7.
What is the molecular formula of N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide?
The molecular formula of N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide is C8H9FN4S2.
What is the molecular weight of N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide?
The molecular weight of N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide is 244.03 g/mol.
Where can I buy N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide?
You can request a quote for N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorophenyl)-1,2-hydrazinedicarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.