Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate
TL;DR: Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate (CAS 433247-26-8) is a chemical compound with molecular formula C15H21N3O6S and molecular weight 371.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate
Also Known As: ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate, ethyl 4-[(2,4-dimethyl-5-nitrophenyl)sulfonyl]piperazinecarboxylate, ethyl 4-((2,4-dimethyl-5-nitrophenyl)sulfonyl)piperazine-1-carboxylate, ethyl 4-[(2,4-dimethyl-5-nitrophenyl)sulfonyl]-1-piperazinecarboxylate, ethyl 4-[(2,4-dimethyl-5-nitrophenyl)sulfonyl]piperazine-1-carboxylate
| Molecular Formula | C15H21N3O6S |
|---|---|
| Molecular Weight | 371.12 g/mol |
| LogP | 1.67444 |
| Topological Polar Surface Area | 110.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.1151 |
| Heavy Atoms | 25 |
| Complexity | 784.7016 |
Chemical Identifiers
| CAS Number | 433247-26-8 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)[N+](=O)[O-])C)C |
Product Overview
Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate (CAS 433247-26-8), with molecular formula C15H21N3O6S and molecular weight 371.12 g/mol. IUPAC: ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate
Property Insights of Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate
The XLogP value of 1.67444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate. The TPSA of 110.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate has 0 hydrogen bond donor(s) and 6 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-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate?
The CAS number of Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate is 433247-26-8.
What is the molecular formula of Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate?
The molecular formula of Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate is C15H21N3O6S.
What is the molecular weight of Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate?
The molecular weight of Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate is 371.12 g/mol.
Where can I buy Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate?
You can request a quote for Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-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-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(2,4-dimethyl-5-nitrophenyl)sulfonylpiperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.