N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline
TL;DR: N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline (CAS 73259-32-2) is a chemical compound with molecular formula C14H12ClN3 and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline
Also Known As: N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline, J3.063.165J, N-(4-Chlorophenyl)-1H-benzoimidazole-2-methaneamine, N-((1h-benzo[d]imidazol-2-yl)methyl)-4-chloroaniline, N-[(1H-1,3-Benzimidazol-2-yl)methyl]-4-chloroaniline
| Molecular Formula | C14H12ClN3 |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 40.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.07196 |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 73259-32-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)CNC3=CC=C(C=C3)Cl |
| InChIKey | YYVYLJWNGGTNJK-UHFFFAOYSA-N |
Product Overview
N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline (CAS 73259-32-2), with molecular formula C14H12ClN3 and molecular weight 257.07 g/mol. IUPAC: N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline.
Chemical Property Profile of N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline
Property Insights of N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline
The XLogP value of 3.9 indicates that N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.7 Ų, N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline has 2 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-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline?
The CAS number of N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline is 73259-32-2.
What is the molecular formula of N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline?
The molecular formula of N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline is C14H12ClN3.
What is the molecular weight of N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline?
The molecular weight of N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline is 257.07 g/mol.
Where can I buy N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline?
You can request a quote for N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-benzimidazol-2-ylmethyl)-4-chloroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.