2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide
TL;DR: 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide (CAS 121-55-1) is a chemical compound with molecular formula C10H13N3O2S2 and molecular weight 271.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4-ethylsulfonylphenyl)methylideneamino]thiourea
Also Known As: Ethicetazone, Subathizone, [(4-ethylsulfonylphenyl)methylideneamino]thiourea, [(E)-(4-ethylsulfonylphenyl)methylideneamino]thiourea, 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide
| Molecular Formula | C10H13N3O2S2 |
|---|---|
| Molecular Weight | 271.04 g/mol |
| LogP | 0.6473 |
| Topological Polar Surface Area | 84.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.04492 |
| Heavy Atoms | 17 |
| Complexity | 520.98694 |
Chemical Identifiers
| CAS Number | 121-55-1 |
|---|---|
| SMILES | CCS(=O)(=O)C1=CC=C(C=C1)C=NNC(=S)N |
Product Overview
2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide (CAS 121-55-1), with molecular formula C10H13N3O2S2 and molecular weight 271.04 g/mol. IUPAC: [(4-ethylsulfonylphenyl)methylideneamino]thiourea.
Chemical Property Profile of 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide
Property Insights of 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide
The XLogP value of 0.6473 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide. The TPSA of 84.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide. Following Lipinski's Rule of Five, 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide has 2 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 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide?
The CAS number of 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide is 121-55-1.
What is the molecular formula of 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide?
The molecular formula of 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide is C10H13N3O2S2.
What is the molecular weight of 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide?
The molecular weight of 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide is 271.04 g/mol.
Where can I buy 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide?
You can request a quote for 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(Ethanesulfonyl)phenyl]methylidene}hydrazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.