1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine
TL;DR: 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine (CAS 324778-90-7) is a chemical compound with molecular formula C18H18ClN3O3 and molecular weight 359.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylpiperazin-1-yl)-(2-chloro-5-nitrophenyl)methanone
Also Known As: BAS 00542152, AB00087348-01, 1-BENZYL-4-(2-CHLORO-5-NITROBENZOYL)PIPERAZINE, 2-chloro-5-nitrophenyl 4-benzylpiperazinyl ketone, (4-benzylpiperazin-1-yl)-(2-chloro-5-nitrophenyl)methanone
| Molecular Formula | C18H18ClN3O3 |
|---|---|
| Molecular Weight | 359.10 g/mol |
| LogP | 3.2062 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.10367 |
| Heavy Atoms | 25 |
| Complexity | 774.3907 |
Chemical Identifiers
| CAS Number | 324778-90-7 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl |
Product Overview
1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine (CAS 324778-90-7), with molecular formula C18H18ClN3O3 and molecular weight 359.10 g/mol. IUPAC: (4-benzylpiperazin-1-yl)-(2-chloro-5-nitrophenyl)methanone.
Chemical Property Profile of 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine
Property Insights of 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine
The XLogP value of 3.2062 indicates that 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine 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 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine. Following Lipinski's Rule of Five, 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine 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 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine?
The CAS number of 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine is 324778-90-7.
What is the molecular formula of 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine?
The molecular formula of 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine is C18H18ClN3O3.
What is the molecular weight of 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine?
The molecular weight of 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine is 359.10 g/mol.
Where can I buy 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine?
You can request a quote for 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-4-(2-chloro-5-nitrobenzoyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.