![[4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone structure](/static/products/3306/330636-41-4.webp)
[4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone
TL;DR: [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone (CAS 330636-41-4) is a chemical compound with molecular formula C18H18FN3O3 and molecular weight 343.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone
Also Known As: AB00096627-01, 1-benzoyl-4-(2-fluoro-5-methyl-4-nitrophenyl)piperazine, [4-(2-fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone, 1-benzoyl-4-{2-fluoro-4-nitro-5-methylphenyl}piperazine, A1813/0076653
| Molecular Formula | C18H18FN3O3 |
|---|---|
| Molecular Weight | 343.13 g/mol |
| LogP | 3.00472 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.1332 |
| Heavy Atoms | 25 |
| Complexity | 802.7136 |
Chemical Identifiers
| CAS Number | 330636-41-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1[N+](=O)[O-])F)N2CCN(CC2)C(=O)C3=CC=CC=C3 |
Product Overview
[4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone (CAS 330636-41-4), with molecular formula C18H18FN3O3 and molecular weight 343.13 g/mol. IUPAC: [4-(2-fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone.
Chemical Property Profile of [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone
Property Insights of [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone
The XLogP value of 3.00472 indicates that [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone. Following Lipinski's Rule of Five, [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone 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-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone?
The CAS number of [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone is 330636-41-4.
What is the molecular formula of [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone?
The molecular formula of [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone is C18H18FN3O3.
What is the molecular weight of [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone?
The molecular weight of [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone is 343.13 g/mol.
Where can I buy [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone?
You can request a quote for [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(2-Fluoro-5-methyl-4-nitrophenyl)piperazin-1-yl]-phenylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.