![ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate structure](/static/products/3097/309743-25-7.webp)
ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate
TL;DR: ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate (CAS 309743-25-7) is a chemical compound with molecular formula C16H22N4O2S and molecular weight 334.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate
Also Known As: ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate, ethyl 4-[(3-methyl-2-thioxo-2,3-dihydro-1H-benzimidazol-1-yl)methyl]piperazine-1-carboxylate, Ethyl 4-[(3-methyl-2-sulfanylidene-benzoimidazol-1-yl)methyl]piperazine-1-carboxylate, ethyl 4-[(3-methyl-2-thioxo-3-hydrobenzimidazolyl)methyl]piperazinecarboxylate, ethyl 4-((3-methyl-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)methyl)piperazine-1-carboxylate
| Molecular Formula | C16H22N4O2S |
|---|---|
| Molecular Weight | 334.15 g/mol |
| LogP | 2.44089 |
| Topological Polar Surface Area | 42.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.14636 |
| Heavy Atoms | 23 |
| Complexity | 759.0163 |
Chemical Identifiers
| CAS Number | 309743-25-7 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CN2C3=CC=CC=C3N(C2=S)C |
Product Overview
ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate (CAS 309743-25-7), with molecular formula C16H22N4O2S and molecular weight 334.15 g/mol. IUPAC: ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate
Property Insights of ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate
The XLogP value of 2.44089 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate. With a topological polar surface area (TPSA) of 42.64 Ų, ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate has 0 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 ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate?
The CAS number of ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate is 309743-25-7.
What is the molecular formula of ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate?
The molecular formula of ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate is C16H22N4O2S.
What is the molecular weight of ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate?
The molecular weight of ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate is 334.15 g/mol.
Where can I buy ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate?
You can request a quote for ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.