N-(benzylideneamino)-3-chloroaniline
TL;DR: N-(benzylideneamino)-3-chloroaniline (CAS 2989-41-5) is a chemical compound with molecular formula C13H11ClN2 and molecular weight 230.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzylideneamino)-3-chloroaniline
Also Known As: Benzaldehyde 3-chlorophenylhydrazone, N-(benzylideneamino)-3-chloroaniline, Benzaldehyde, (m-chlorophenyl)hydrazone, Benzaldehyde,2-(3-chlorophenyl)hydrazone, 4-15-00-00262 (Beilstein Handbook Reference)
| Molecular Formula | C13H11ClN2 |
|---|---|
| Molecular Weight | 230.06 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.06108 |
| Heavy Atoms | 16 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 2989-41-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=NNC2=CC(=CC=C2)Cl |
| InChIKey | GZZYOYAUOJLPOX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(benzylideneamino)-3-chloroaniline (CAS 2989-41-5), with molecular formula C13H11ClN2 and molecular weight 230.06 g/mol. IUPAC: N-(benzylideneamino)-3-chloroaniline.
Chemical Property Profile of N-(benzylideneamino)-3-chloroaniline
Property Insights of N-(benzylideneamino)-3-chloroaniline
The XLogP value of 4.2 indicates that N-(benzylideneamino)-3-chloroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.4 Ų, N-(benzylideneamino)-3-chloroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(benzylideneamino)-3-chloroaniline has 1 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 N-(benzylideneamino)-3-chloroaniline?
The CAS number of N-(benzylideneamino)-3-chloroaniline is 2989-41-5.
What is the molecular formula of N-(benzylideneamino)-3-chloroaniline?
The molecular formula of N-(benzylideneamino)-3-chloroaniline is C13H11ClN2.
What is the molecular weight of N-(benzylideneamino)-3-chloroaniline?
The molecular weight of N-(benzylideneamino)-3-chloroaniline is 230.06 g/mol.
Where can I buy N-(benzylideneamino)-3-chloroaniline?
You can request a quote for N-(benzylideneamino)-3-chloroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(benzylideneamino)-3-chloroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(benzylideneamino)-3-chloroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.