N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide
TL;DR: N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide (CAS 587-92-8) is a chemical compound with molecular formula C14H13FN4S2 and molecular weight 320.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-3-(phenylcarbamothioylamino)thiourea
Also Known As: N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide, 1-(4-fluorophenyl)-3-(phenylcarbamothioylamino)thiourea, 1-(4-fluorophenyl)-3-(phenylthiocarbamoylamino)thiourea, 1-[[anilino(sulfanylidene)methyl]amino]-3-(4-fluorophenyl)thiourea
| Molecular Formula | C14H13FN4S2 |
|---|---|
| Molecular Weight | 320.06 g/mol |
| LogP | 3.0137 |
| Topological Polar Surface Area | 48.12 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.05658 |
| Heavy Atoms | 21 |
| Complexity | 616.6309 |
Chemical Identifiers
| CAS Number | 587-92-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NNC(=S)NC2=CC=C(C=C2)F |
Product Overview
N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide (CAS 587-92-8), with molecular formula C14H13FN4S2 and molecular weight 320.06 g/mol. IUPAC: 1-(4-fluorophenyl)-3-(phenylcarbamothioylamino)thiourea.
Chemical Property Profile of N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide
Property Insights of N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide
The XLogP value of 3.0137 indicates that N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.12 Ų, N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide has 4 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 N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide?
The CAS number of N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide is 587-92-8.
What is the molecular formula of N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide?
The molecular formula of N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide is C14H13FN4S2.
What is the molecular weight of N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide?
The molecular weight of N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide is 320.06 g/mol.
Where can I buy N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide?
You can request a quote for N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide 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)-N'-phenylhydrazine-1,2-dicarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorophenyl)-N'-phenylhydrazine-1,2-dicarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.