![[4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone structure](/static/products/4237/423740-61-8.webp)
[4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone
TL;DR: [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone (CAS 423740-61-8) is a chemical compound with molecular formula C18H17N3O4 and molecular weight 339.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-nitrobenzoyl)piperazin-1-yl]-phenylmethanone
Also Known As: BAS 03050136, [4-(4-nitrobenzoyl)piperazin-1-yl]-phenylmethanone, 1-BENZOYL-4-(4-NITROBENZOYL)PIPERAZINE, (4-Benzoyl-piperazin-1-yl)-(4-nitro-phenyl)-methanone, 4-nitrophenyl 4-(phenylcarbonyl)piperazinyl ketone
| Molecular Formula | C18H17N3O4 |
|---|---|
| Molecular Weight | 339.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 86.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.12192 |
| Heavy Atoms | 25 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 423740-61-8 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | HDFNPPJLPUHQAX-UHFFFAOYSA-N |
Product Overview
[4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone (CAS 423740-61-8), with molecular formula C18H17N3O4 and molecular weight 339.12 g/mol. IUPAC: [4-(4-nitrobenzoyl)piperazin-1-yl]-phenylmethanone.
Chemical Property Profile of [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone
Property Insights of [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone. The TPSA of 86.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone. Following Lipinski's Rule of Five, [4-(4-Nitrobenzoyl)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-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone?
The CAS number of [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone is 423740-61-8.
What is the molecular formula of [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone?
The molecular formula of [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone is C18H17N3O4.
What is the molecular weight of [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone?
The molecular weight of [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone is 339.12 g/mol.
Where can I buy [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone?
You can request a quote for [4-(4-Nitrobenzoyl)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-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-Nitrobenzoyl)piperazin-1-yl]-phenylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.