1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate
TL;DR: 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate (CAS 339010-14-9) is a chemical compound with molecular formula C18H17ClN2O4 and molecular weight 360.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-nitrophenyl)piperidin-4-yl] 4-chlorobenzoate
Also Known As: Bionet1_001150, [1-(4-nitrophenyl)piperidin-4-yl] 4-chlorobenzoate, 1-(4-nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate, 7F-909, 1-(4-nitrophenyl)piperidin-4-yl 4-chlorobenzoate
| Molecular Formula | C18H17ClN2O4 |
|---|---|
| Molecular Weight | 360.09 g/mol |
| LogP | 4.074 |
| Topological Polar Surface Area | 72.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.08768 |
| Heavy Atoms | 25 |
| Complexity | 753.65045 |
Chemical Identifiers
| CAS Number | 339010-14-9 |
|---|---|
| SMILES | C1CN(CCC1OC(=O)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate (CAS 339010-14-9), with molecular formula C18H17ClN2O4 and molecular weight 360.09 g/mol. IUPAC: [1-(4-nitrophenyl)piperidin-4-yl] 4-chlorobenzoate.
Chemical Property Profile of 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate
Property Insights of 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate
The XLogP value of 4.074 indicates that 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate 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 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate?
The CAS number of 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate is 339010-14-9.
What is the molecular formula of 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate?
The molecular formula of 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate is C18H17ClN2O4.
What is the molecular weight of 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate?
The molecular weight of 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate is 360.09 g/mol.
Where can I buy 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate?
You can request a quote for 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrophenyl)-4-piperidinyl 4-chlorobenzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.