5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione
TL;DR: 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione (CAS 420107-27-3) is a chemical compound with molecular formula C20H13N3O5 and molecular weight 375.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione
Also Known As: 5-(3-nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione, AB00096027-01, 5-(3-nitrophenoxy)-2-(3-pyridinylmethyl)-1H-isoindole-1,3(2H)-dione, 5-(3-nitrophenoxy)-2-(pyridin-3-ylmethyl)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C20H13N3O5 |
|---|---|
| Molecular Weight | 375.09 g/mol |
| LogP | 3.5783 |
| Topological Polar Surface Area | 102.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.0855 |
| Heavy Atoms | 28 |
| Complexity | 1098.0051 |
Chemical Identifiers
| CAS Number | 420107-27-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CN=CC=C4)[N+](=O)[O-] |
Product Overview
5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione (CAS 420107-27-3), with molecular formula C20H13N3O5 and molecular weight 375.09 g/mol. IUPAC: 5-(3-nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione.
Chemical Property Profile of 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione
Property Insights of 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione
The XLogP value of 3.5783 indicates that 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione. Following Lipinski's Rule of Five, 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione has 0 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 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione?
The CAS number of 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione is 420107-27-3.
What is the molecular formula of 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione?
The molecular formula of 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione is C20H13N3O5.
What is the molecular weight of 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione?
The molecular weight of 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione is 375.09 g/mol.
Where can I buy 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione?
You can request a quote for 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-Nitrophenoxy)-2-(pyridin-3-ylmethyl)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.