methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate
TL;DR: methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate (CAS 708227-87-6) is a chemical compound with molecular formula C16H24N4O2S3 and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(cyclohexylcarbamothioylamino)carbamothioylamino]-5-ethylthiophene-3-carboxylate
Also Known As: methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate, methyl 2-[(cyclohexylcarbamothioylamino)carbamothioylamino]-5-ethylthiophene-3-carboxylate, methyl 2-({[2-(cyclohexylcarbamothioyl)hydrazinyl]carbonothioyl}amino)-5-ethylthiophene-3-carboxylate, methyl 2-[({2-[(cyclohexylamino)thioxomethyl]hydrazino}thioxomethyl)amino]-5-e thylthiophene-3-carboxylate
| Molecular Formula | C16H24N4O2S3 |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 3.0953 |
| Topological Polar Surface Area | 74.42 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.10614 |
| Heavy Atoms | 25 |
| Complexity | 626.89606 |
Chemical Identifiers
| CAS Number | 708227-87-6 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=S)NNC(=S)NC2CCCCC2)C(=O)OC |
Product Overview
methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate (CAS 708227-87-6), with molecular formula C16H24N4O2S3 and molecular weight 400.11 g/mol. IUPAC: methyl 2-[(cyclohexylcarbamothioylamino)carbamothioylamino]-5-ethylthiophene-3-carboxylate.
Chemical Property Profile of methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate
Property Insights of methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate
The XLogP value of 3.0953 indicates that methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.42 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate has 4 hydrogen bond donor(s) and 5 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 methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate?
The CAS number of methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate is 708227-87-6.
What is the molecular formula of methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate?
The molecular formula of methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate is C16H24N4O2S3.
What is the molecular weight of methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate?
The molecular weight of methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate is 400.11 g/mol.
Where can I buy methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate?
You can request a quote for methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(2-(cyclohexylcarbamothioyl)hydrazinecarbothioamido)-5-ethylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.