2-(4-Butyrylamino-2-nitrobenzyl)pyridine
TL;DR: 2-(4-Butyrylamino-2-nitrobenzyl)pyridine (CAS 63233-46-5) is a chemical compound with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]butanamide
Also Known As: 2-(4-Butyrylamino-2-nitrobenzyl)pyridine, KW 6055, N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]butanamide, alpha-(p'-Butyrylamino-o-nitrobenzyl)pyridine, N-(3-Nitro-4-(2-pyridinylmethyl)phenyl)butanamide
| Molecular Formula | C16H17N3O3 |
|---|---|
| Molecular Weight | 299.13 g/mol |
| LogP | 3.3192 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.12698 |
| Heavy Atoms | 22 |
| Complexity | 671.5912 |
Chemical Identifiers
| CAS Number | 63233-46-5 |
|---|---|
| SMILES | CCCC(=O)NC1=CC(=C(C=C1)CC2=CC=CC=N2)[N+](=O)[O-] |
Product Overview
2-(4-Butyrylamino-2-nitrobenzyl)pyridine (CAS 63233-46-5), with molecular formula C16H17N3O3 and molecular weight 299.13 g/mol. IUPAC: N-[3-nitro-4-(pyridin-2-ylmethyl)phenyl]butanamide.
Chemical Property Profile of 2-(4-Butyrylamino-2-nitrobenzyl)pyridine
Property Insights of 2-(4-Butyrylamino-2-nitrobenzyl)pyridine
The XLogP value of 3.3192 indicates that 2-(4-Butyrylamino-2-nitrobenzyl)pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Butyrylamino-2-nitrobenzyl)pyridine. Following Lipinski's Rule of Five, 2-(4-Butyrylamino-2-nitrobenzyl)pyridine 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 2-(4-Butyrylamino-2-nitrobenzyl)pyridine?
The CAS number of 2-(4-Butyrylamino-2-nitrobenzyl)pyridine is 63233-46-5.
What is the molecular formula of 2-(4-Butyrylamino-2-nitrobenzyl)pyridine?
The molecular formula of 2-(4-Butyrylamino-2-nitrobenzyl)pyridine is C16H17N3O3.
What is the molecular weight of 2-(4-Butyrylamino-2-nitrobenzyl)pyridine?
The molecular weight of 2-(4-Butyrylamino-2-nitrobenzyl)pyridine is 299.13 g/mol.
Where can I buy 2-(4-Butyrylamino-2-nitrobenzyl)pyridine?
You can request a quote for 2-(4-Butyrylamino-2-nitrobenzyl)pyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Butyrylamino-2-nitrobenzyl)pyridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Butyrylamino-2-nitrobenzyl)pyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.