ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate
TL;DR: ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate (CAS 505052-06-2) is a chemical compound with molecular formula C17H25N3O5S and molecular weight 383.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]piperazine-1-carboxylate
Also Known As: BAS 03106965, AH-487/40673135, ethyl 4-(2-(N,4-dimethylphenylsulfonamido)acetyl)piperazine-1-carboxylate, ethyl 4-({methyl[(4-methylphenyl)sulfonyl]amino}acetyl)-1-piperazinecarboxylate, ethyl 4-[2-(N-methyl-4-methylbenzenesulfonamido)acetyl]piperazine-1-carboxylate
| Molecular Formula | C17H25N3O5S |
|---|---|
| Molecular Weight | 383.15 g/mol |
| LogP | 0.91622 |
| Topological Polar Surface Area | 87.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.1515 |
| Heavy Atoms | 26 |
| Complexity | 740.1668 |
Chemical Identifiers
| CAS Number | 505052-06-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate (CAS 505052-06-2), with molecular formula C17H25N3O5S and molecular weight 383.15 g/mol. IUPAC: ethyl 4-[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate
Property Insights of ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate
The XLogP value of 0.91622 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate. The TPSA of 87.23 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate has 0 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 ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
The CAS number of ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate is 505052-06-2.
What is the molecular formula of ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
The molecular formula of ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate is C17H25N3O5S.
What is the molecular weight of ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
The molecular weight of ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate is 383.15 g/mol.
Where can I buy ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
You can request a quote for ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}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-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{N-methyl-N-[(4-methylphenyl)sulfonyl]glycyl}piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.