2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate
TL;DR: 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate (CAS 7511-25-3) is a chemical compound with molecular formula C23H23N3O7 and molecular weight 453.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate
Also Known As: 2-[3-ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate, 2-[3-ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrob
| Molecular Formula | C23H23N3O7 |
|---|---|
| Molecular Weight | 453.15 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 453.1536 |
| Heavy Atoms | 33 |
| Complexity | 731.0 |
Chemical Identifiers
| CAS Number | 7511-25-3 |
|---|---|
| SMILES | C=CC1CN(CCC1CCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | MZSAPNDKETUPMU-UHFFFAOYSA-N |
Product Overview
2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate (CAS 7511-25-3), with molecular formula C23H23N3O7 and molecular weight 453.15 g/mol. IUPAC: 2-[3-ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate.
Chemical Property Profile of 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate
Property Insights of 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate
The XLogP value of 4.2 indicates that 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate. Following Lipinski's Rule of Five, 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate has 0 hydrogen bond donor(s) and 7 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 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate?
The CAS number of 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate is 7511-25-3.
What is the molecular formula of 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate?
The molecular formula of 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate is C23H23N3O7.
What is the molecular weight of 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate?
The molecular weight of 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate is 453.15 g/mol.
Where can I buy 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate?
You can request a quote for 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-Ethenyl-1-(4-nitrobenzoyl)piperidin-4-yl]ethyl 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.