(4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone
TL;DR: (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone (CAS 353773-46-3) is a chemical compound with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethylpiperazin-1-yl)-(2-methyl-3-nitrophenyl)methanone
Also Known As: 1-Ethyl-4-{3-nitro-2-methylbenzoyl}, 1-ethyl-4-{3-nitro-2-methylbenzoyl}piperazine, (4-ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone, (4-ethylpiperazin-1-yl)-(2-methyl-3-nitrophenyl)methanone, 4-ethylpiperazinyl 2-methyl-3-nitrophenyl ketone
| Molecular Formula | C14H19N3O3 |
|---|---|
| Molecular Weight | 277.14 g/mol |
| LogP | 1.68092 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.14264 |
| Heavy Atoms | 20 |
| Complexity | 522.39545 |
Chemical Identifiers
| CAS Number | 353773-46-3 |
|---|---|
| SMILES | CCN1CCN(CC1)C(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C |
Product Overview
(4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone (CAS 353773-46-3), with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol. IUPAC: (4-ethylpiperazin-1-yl)-(2-methyl-3-nitrophenyl)methanone.
Chemical Property Profile of (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone
Property Insights of (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone
The XLogP value of 1.68092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone. Following Lipinski's Rule of Five, (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone has 0 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 (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone?
The CAS number of (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone is 353773-46-3.
What is the molecular formula of (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone?
The molecular formula of (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone is C14H19N3O3.
What is the molecular weight of (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone?
The molecular weight of (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone is 277.14 g/mol.
Where can I buy (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone?
You can request a quote for (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Ethylpiperazin-1-yl)(2-methyl-3-nitrophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.