3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one
TL;DR: 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one (CAS 345237-61-8) is a chemical compound with molecular formula C19H19N3O5 and molecular weight 369.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one
Also Known As: BAS 01006667, 3-ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one, 2,6-bis(4-nitrophenyl)-3-ethylpiperidin-4-one, 3-ethyl-2,6-bis{4-nitrophenyl}-4-piperidinone, AM-760/11790006
| Molecular Formula | C19H19N3O5 |
|---|---|
| Molecular Weight | 369.13 g/mol |
| LogP | 3.874 |
| Topological Polar Surface Area | 115.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.13248 |
| Heavy Atoms | 27 |
| Complexity | 863.91876 |
Chemical Identifiers
| CAS Number | 345237-61-8 |
|---|---|
| SMILES | CCC1C(NC(CC1=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one (CAS 345237-61-8), with molecular formula C19H19N3O5 and molecular weight 369.13 g/mol. IUPAC: 3-ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one.
Chemical Property Profile of 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one
Property Insights of 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one
The XLogP value of 3.874 indicates that 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one. Following Lipinski's Rule of Five, 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one has 1 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 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one?
The CAS number of 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one is 345237-61-8.
What is the molecular formula of 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one?
The molecular formula of 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one is C19H19N3O5.
What is the molecular weight of 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one?
The molecular weight of 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one is 369.13 g/mol.
Where can I buy 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one?
You can request a quote for 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-2,6-bis(4-nitrophenyl)piperidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.