5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline
TL;DR: 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline (CAS 347355-91-3) is a chemical compound with molecular formula C12H10ClN3O2 and molecular weight 263.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline
Also Known As: 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline, 3-({5-chloro-2-nitroanilino}methyl)pyridine, N-(3-pyridylmethyl)-5-chloro-2-nitroaniline, (5-chloro-2-nitrophenyl)(3-pyridylmethyl)amine, AB00109310-01
| Molecular Formula | C12H10ClN3O2 |
|---|---|
| Molecular Weight | 263.05 g/mol |
| LogP | 3.2553 |
| Topological Polar Surface Area | 68.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.04614 |
| Heavy Atoms | 18 |
| Complexity | 560.5039 |
Chemical Identifiers
| CAS Number | 347355-91-3 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC2=C(C=CC(=C2)Cl)[N+](=O)[O-] |
Product Overview
5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline (CAS 347355-91-3), with molecular formula C12H10ClN3O2 and molecular weight 263.05 g/mol. IUPAC: 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline.
Chemical Property Profile of 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline
Property Insights of 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline
The XLogP value of 3.2553 indicates that 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline. Following Lipinski's Rule of Five, 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline has 1 hydrogen bond donor(s) and 4 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 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline?
The CAS number of 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline is 347355-91-3.
What is the molecular formula of 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline?
The molecular formula of 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline is C12H10ClN3O2.
What is the molecular weight of 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline?
The molecular weight of 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline is 263.05 g/mol.
Where can I buy 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline?
You can request a quote for 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-2-nitro-N-(pyridin-3-ylmethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.