3-Nitrophenyl 4-phenylpiperazinyl ketone
TL;DR: 3-Nitrophenyl 4-phenylpiperazinyl ketone (CAS 21092-00-2) is a chemical compound with molecular formula C17H17N3O3 and molecular weight 311.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
Also Known As: BAS 00623535, 3-nitrophenyl 4-phenylpiperazinyl ketone, (3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone, 1-(3-NITROBENZOYL)-4-PHENYLPIPERAZINE, (3-nitrophenyl)(4-phenylpiperazin-1-yl)methanone
| Molecular Formula | C17H17N3O3 |
|---|---|
| Molecular Weight | 311.13 g/mol |
| LogP | 2.5572 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.12698 |
| Heavy Atoms | 23 |
| Complexity | 710.0333 |
Chemical Identifiers
| CAS Number | 21092-00-2 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
3-Nitrophenyl 4-phenylpiperazinyl ketone (CAS 21092-00-2), with molecular formula C17H17N3O3 and molecular weight 311.13 g/mol. IUPAC: (3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone.
Chemical Property Profile of 3-Nitrophenyl 4-phenylpiperazinyl ketone
Property Insights of 3-Nitrophenyl 4-phenylpiperazinyl ketone
The XLogP value of 2.5572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitrophenyl 4-phenylpiperazinyl ketone. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitrophenyl 4-phenylpiperazinyl ketone. Following Lipinski's Rule of Five, 3-Nitrophenyl 4-phenylpiperazinyl ketone 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 3-Nitrophenyl 4-phenylpiperazinyl ketone?
The CAS number of 3-Nitrophenyl 4-phenylpiperazinyl ketone is 21092-00-2.
What is the molecular formula of 3-Nitrophenyl 4-phenylpiperazinyl ketone?
The molecular formula of 3-Nitrophenyl 4-phenylpiperazinyl ketone is C17H17N3O3.
What is the molecular weight of 3-Nitrophenyl 4-phenylpiperazinyl ketone?
The molecular weight of 3-Nitrophenyl 4-phenylpiperazinyl ketone is 311.13 g/mol.
Where can I buy 3-Nitrophenyl 4-phenylpiperazinyl ketone?
You can request a quote for 3-Nitrophenyl 4-phenylpiperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitrophenyl 4-phenylpiperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitrophenyl 4-phenylpiperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.