![methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate structure](/static/products/7012/701288-09-7.webp)
methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
TL;DR: methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate (CAS 701288-09-7) is a chemical compound with molecular formula C27H30N4O4S3 and molecular weight 570.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(diethylcarbamoyl)-4-methyl-2-[[(2-phenyl-2-phenylsulfanylacetyl)amino]carbamothioylamino]thiophene-3-carboxylate
Also Known As: methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate, methyl 5-(diethylcarbamoyl)-4-methyl-2-(2-(2-phenyl-2-(phenylthio)acetyl)hydrazinecarbothioamido)thiophene-3-carboxylate, methyl 5-(diethylcarbamoyl)-4-methyl-2-[[(2-phenyl-2-phenylsulfanylacetyl)amino]carbamothioylamino]thiophene-3-carboxylate, methyl 5-(N,N-diethylcarbamoyl)-4-methyl-2-({[(2-phenyl-2-phenylthioacetylamin o)amino]thioxomethyl}amino)thiophene-3-carboxylate
| Molecular Formula | C27H30N4O4S3 |
|---|---|
| Molecular Weight | 570.14 g/mol |
| LogP | 5.17632 |
| Topological Polar Surface Area | 99.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 570.14294 |
| Heavy Atoms | 38 |
| Complexity | 1278.2346 |
Chemical Identifiers
| CAS Number | 701288-09-7 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=S)NNC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3)C(=O)OC)C |
Product Overview
methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate (CAS 701288-09-7), with molecular formula C27H30N4O4S3 and molecular weight 570.14 g/mol. IUPAC: methyl 5-(diethylcarbamoyl)-4-methyl-2-[[(2-phenyl-2-phenylsulfanylacetyl)amino]carbamothioylamino]thiophene-3-carboxylate.
Chemical Property Profile of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
Property Insights of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
The XLogP value of 5.17632 indicates that methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.77 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
The CAS number of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is 701288-09-7.
What is the molecular formula of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
The molecular formula of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is C27H30N4O4S3.
What is the molecular weight of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
The molecular weight of methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is 570.14 g/mol.
Where can I buy methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
You can request a quote for methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-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 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-(diethylcarbamoyl)-4-methyl-2-[({2-[phenyl(phenylsulfanyl)acetyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.