1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-
TL;DR: 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- (CAS 79070-65-8) is a chemical compound with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxyethyl)-5-nitrobenzo[de]isoquinoline-1,3-dione
Also Known As: Maybridge1_005618, DivK1c_001906, CDS1_000866, PHG 00249, BAS 00430010
| Molecular Formula | C14H10N2O5 |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.05896 |
| Heavy Atoms | 21 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 79070-65-8 |
|---|---|
| SMILES | C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)CCO)[N+](=O)[O-] |
| InChIKey | DZWAVLDRXDPZOM-UHFFFAOYSA-N |
Product Overview
1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- (CAS 79070-65-8), with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol. IUPAC: 2-(2-hydroxyethyl)-5-nitrobenzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-
Property Insights of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-. Following Lipinski's Rule of Five, 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- has 1 hydrogen bond donor(s) and 5 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 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-?
The CAS number of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- is 79070-65-8.
What is the molecular formula of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-?
The molecular formula of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- is C14H10N2O5.
What is the molecular weight of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-?
The molecular weight of 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- is 286.06 g/mol.
Where can I buy 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-?
You can request a quote for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(2-hydroxyethyl)-5-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.