4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone
TL;DR: 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone (CAS 130564-58-8) is a chemical compound with molecular formula C20H25N3O and molecular weight 323.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylpiperazin-1-yl)-[4-(dimethylamino)phenyl]methanone
Also Known As: BAS 00785623, BIM-0009178.P001, 4-(dimethylamino)phenyl 4-benzylpiperazinyl ketone, AE-641/00359005, (4-Benzyl-piperazin-1-yl)-(4-dimethylamino-phenyl)-methanone
| Molecular Formula | C20H25N3O |
|---|---|
| Molecular Weight | 323.20 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.19977 |
| Heavy Atoms | 24 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 130564-58-8 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC=C3 |
| InChIKey | LKIFJNJBDORNCI-UHFFFAOYSA-N |
Product Overview
4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone (CAS 130564-58-8), with molecular formula C20H25N3O and molecular weight 323.20 g/mol. IUPAC: (4-benzylpiperazin-1-yl)-[4-(dimethylamino)phenyl]methanone.
Chemical Property Profile of 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone
Property Insights of 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone. With a topological polar surface area (TPSA) of 26.8 Ų, 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone has 0 hydrogen bond donor(s) and 3 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-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone?
The CAS number of 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone is 130564-58-8.
What is the molecular formula of 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone?
The molecular formula of 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone is C20H25N3O.
What is the molecular weight of 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone?
The molecular weight of 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone is 323.20 g/mol.
Where can I buy 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone?
You can request a quote for 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 4-(Dimethylamino)phenyl 4-benzylpiperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.