n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride
TL;DR: n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride (CAS 77053-57-7) is a chemical compound with molecular formula C12H14ClN3O2 and molecular weight 267.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-nitrophenyl)piperidine-1-carboximidoyl chloride
Also Known As: n-(4-nitrophenyl)piperidine-1-carboximidoyl chloride, 1-Piperidinecarboximidoylchloride, N-(4-nitrophenyl)-
| Molecular Formula | C12H14ClN3O2 |
|---|---|
| Molecular Weight | 267.08 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.07745 |
| Heavy Atoms | 18 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 77053-57-7 |
|---|---|
| SMILES | C1CCN(CC1)C(=NC2=CC=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | SFADOKJFZGSDBG-UHFFFAOYSA-N |
Product Overview
n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride (CAS 77053-57-7), with molecular formula C12H14ClN3O2 and molecular weight 267.08 g/mol. IUPAC: N-(4-nitrophenyl)piperidine-1-carboximidoyl chloride.
Chemical Property Profile of n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride
Property Insights of n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride
The XLogP value of 3.3 indicates that n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride. Following Lipinski's Rule of Five, n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride has 0 hydrogen bond donor(s) and 3 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 n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride?
The CAS number of n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride is 77053-57-7.
What is the molecular formula of n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride?
The molecular formula of n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride is C12H14ClN3O2.
What is the molecular weight of n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride?
The molecular weight of n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride is 267.08 g/mol.
Where can I buy n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride?
You can request a quote for n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for n-(4-Nitrophenyl)piperidine-1-carboximidoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.