N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine
TL;DR: N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine (CAS 866154-66-7) is a chemical compound with molecular formula C12H9F2N3O2 and molecular weight 265.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3,4-difluorophenyl)methyl]-3-nitropyridin-2-amine
Also Known As: N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine, N-[(3,4-difluorophenyl)methyl]-3-nitropyridin-2-amine, N-[(3,4-difluorophenyl)methyl]-3-nitro-pyridin-2-amine, N-[(3,4-Difluorophenyl)methyl]-3-nitro-2-pyridinamine
| Molecular Formula | C12H9F2N3O2 |
|---|---|
| Molecular Weight | 265.07 g/mol |
| LogP | 2.8801 |
| Topological Polar Surface Area | 68.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.06628 |
| Heavy Atoms | 19 |
| Complexity | 619.6735 |
Chemical Identifiers
| CAS Number | 866154-66-7 |
|---|---|
| SMILES | C1=CC(=C(N=C1)NCC2=CC(=C(C=C2)F)F)[N+](=O)[O-] |
Product Overview
N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine (CAS 866154-66-7), with molecular formula C12H9F2N3O2 and molecular weight 265.07 g/mol. IUPAC: N-[(3,4-difluorophenyl)methyl]-3-nitropyridin-2-amine.
Chemical Property Profile of N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine
Property Insights of N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine
The XLogP value of 2.8801 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine. The TPSA of 68.06 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine. Following Lipinski's Rule of Five, N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine 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 N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine?
The CAS number of N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine is 866154-66-7.
What is the molecular formula of N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine?
The molecular formula of N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine is C12H9F2N3O2.
What is the molecular weight of N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine?
The molecular weight of N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine is 265.07 g/mol.
Where can I buy N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine?
You can request a quote for N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-difluorobenzyl)-3-nitro-2-pyridinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.