![Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester structure](/static/products/3390/339010-16-1.webp)
Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester
TL;DR: Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester (CAS 339010-16-1) is a chemical compound with molecular formula C18H17N3O4 and molecular weight 339.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[1-(4-nitrophenyl)piperidin-4-ylidene]amino] benzoate
Also Known As: 4-[(benzoyloxy)imino]-1-(4-nitrophenyl)piperidine, [[1-(4-nitrophenyl)piperidin-4-ylidene]amino] benzoate, [1-(4-nitrophenyl)piperidin-4-ylidene]amino benzoate, benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester, [[1-(4-nitrophenyl)-4-piperidylidene]amino] benzoate
| Molecular Formula | C18H17N3O4 |
|---|---|
| Molecular Weight | 339.12 g/mol |
| LogP | 3.408 |
| Topological Polar Surface Area | 85.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.12192 |
| Heavy Atoms | 25 |
| Complexity | 777.7283 |
Chemical Identifiers
| CAS Number | 339010-16-1 |
|---|---|
| SMILES | C1CN(CCC1=NOC(=O)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester (CAS 339010-16-1), with molecular formula C18H17N3O4 and molecular weight 339.12 g/mol. IUPAC: [[1-(4-nitrophenyl)piperidin-4-ylidene]amino] benzoate.
Chemical Property Profile of Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester
Property Insights of Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester
The XLogP value of 3.408 indicates that Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.04 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester. Following Lipinski's Rule of Five, Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester 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 Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester?
The CAS number of Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester is 339010-16-1.
What is the molecular formula of Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester?
The molecular formula of Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester is C18H17N3O4.
What is the molecular weight of Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester?
The molecular weight of Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester is 339.12 g/mol.
Where can I buy Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester?
You can request a quote for Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.