2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-
TL;DR: 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- (CAS 111413-22-0) is a chemical compound with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)-N-(2,4-dimethyl-5-nitrophenyl)acetamide
Also Known As: 2-(Diethylamino)-5'-nitro-2',4'-acetoxylidide, 2',4'-ACETOXYLIDIDE, 2-(DIETHYLAMINO)-5'-NITRO-, 2-(diethylamino)-N-(2,4-dimethyl-5-nitrophenyl)acetamide, n-(2,4-dimethyl-5-nitrophenyl)-n2,n2-diethylglycinamide, N-(2,4-Dimethyl-5-nitrophenyl)-N~2~,N~2~-diethylglycinamide
| Molecular Formula | C14H21N3O3 |
|---|---|
| Molecular Weight | 279.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 279.1583 |
| Heavy Atoms | 20 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 111413-22-0 |
|---|---|
| SMILES | CCN(CC)CC(=O)NC1=CC(=C(C=C1C)C)[N+](=O)[O-] |
| InChIKey | MVDXUJGLVDWFHT-UHFFFAOYSA-N |
Product Overview
2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- (CAS 111413-22-0), with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol. IUPAC: 2-(diethylamino)-N-(2,4-dimethyl-5-nitrophenyl)acetamide.
Chemical Property Profile of 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-
Property Insights of 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-. Following Lipinski's Rule of Five, 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- 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'-Acetoxylidide, 2-(diethylamino)-5'-nitro-?
The CAS number of 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- is 111413-22-0.
What is the molecular formula of 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-?
The molecular formula of 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- is C14H21N3O3.
What is the molecular weight of 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-?
The molecular weight of 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- is 279.16 g/mol.
Where can I buy 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-?
You can request a quote for 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 2',4'-Acetoxylidide, 2-(diethylamino)-5'-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.