![2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione structure](/static/products/864/864872-06-0.png)
2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione
TL;DR: 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione (CAS 864872-06-0) is a chemical compound with molecular formula C17H13N3O4 and molecular weight 323.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(5-nitro-2-pyridinyl)ethylamino]naphthalene-1,4-dione
Also Known As: 2-[2-(5-nitropyridin-2-yl)ethylamino]naphthalene-1,4-dione, 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione, 2-{[2-(5-NITROPYRIDIN-2-YL)ETHYL]AMINO}NAPHTHALENE-1,4-DIONE
| Molecular Formula | C17H13N3O4 |
|---|---|
| Molecular Weight | 323.09 g/mol |
| LogP | 2.085 |
| Topological Polar Surface Area | 102.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.0906 |
| Heavy Atoms | 24 |
| Complexity | 856.3943 |
Chemical Identifiers
| CAS Number | 864872-06-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(C2=O)NCCC3=NC=C(C=C3)[N+](=O)[O-] |
Product Overview
2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione (CAS 864872-06-0), with molecular formula C17H13N3O4 and molecular weight 323.09 g/mol. IUPAC: 2-[2-(5-nitro-2-pyridinyl)ethylamino]naphthalene-1,4-dione.
Chemical Property Profile of 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione
Property Insights of 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione
The XLogP value of 2.085 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione. The TPSA of 102.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione. Following Lipinski's Rule of Five, 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione has 1 hydrogen bond donor(s) and 6 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-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione?
The CAS number of 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione is 864872-06-0.
What is the molecular formula of 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione?
The molecular formula of 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione is C17H13N3O4.
What is the molecular weight of 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione?
The molecular weight of 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione is 323.09 g/mol.
Where can I buy 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione?
You can request a quote for 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-(5-Nitro-2-pyridinyl)ethyl]amino]-1,4-naphthalenedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.