2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine
TL;DR: 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine (CAS 32680-29-8) is a chemical compound with molecular formula C13H16ClFN2 and molecular weight 254.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-4-fluorophenyl)-1-propylpyrrolidin-2-imine
Also Known As: 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine, Pyrrolidine, 2-((2-chloro-4-fluorophenyl)imino)-1-propyl-, 2-chloro-4-fluoro-n-[(2e)-1-propylpyrrolidin-2-ylidene]aniline, N-(2-chloro-4-fluorophenyl)-1-propylpyrrolidin-2-imine, Benzenamine, 2-chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)-
| Molecular Formula | C13H16ClFN2 |
|---|---|
| Molecular Weight | 254.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.0986 |
| Heavy Atoms | 17 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 32680-29-8 |
|---|---|
| SMILES | CCCN1CCCC1=NC2=C(C=C(C=C2)F)Cl |
| InChIKey | QPWPQMOLDNRDBD-UHFFFAOYSA-N |
Product Overview
2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine (CAS 32680-29-8), with molecular formula C13H16ClFN2 and molecular weight 254.10 g/mol. IUPAC: N-(2-chloro-4-fluorophenyl)-1-propylpyrrolidin-2-imine.
Chemical Property Profile of 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine
Property Insights of 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine
The XLogP value of 3.2 indicates that 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine has 0 hydrogen bond donor(s) and 2 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-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine?
The CAS number of 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine is 32680-29-8.
What is the molecular formula of 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine?
The molecular formula of 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine is C13H16ClFN2.
What is the molecular weight of 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine?
The molecular weight of 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine is 254.10 g/mol.
Where can I buy 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine?
You can request a quote for 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-fluoro-N-(1-propyl-2-pyrrolidinylidene)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.