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[4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone structure
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[4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone

TL;DR: [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone (CAS 347313-62-6) is a chemical compound with molecular formula C18H18ClN3O3 and molecular weight 359.10367 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone

Also Known As: [4-(2-chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone, 4-(6-chloro-2-nitrophenyl)piperazinyl 3-methylphenyl ketone, 1-(2-CHLORO-6-NITROPHENYL)-4-(3-METHYLBENZOYL)PIPERAZINE, [4-(2-chloro-6-nitrophenyl)piperazin-1-yl](3-methylphenyl)methanone

CAS Number
347313-62-6
Molecular Formula
C18H18ClN3O3
Molecular Weight
359.10367 g/mol
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Technical Specifications

Molecular FormulaC18H18ClN3O3
Molecular Weight359.10367 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)69.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass359.10367 Da
Heavy Atoms25
Complexity490.0
SMILESCC1=CC(=CC=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)[N+](=O)[O-]
InChIKeyJXBUBZWEJIPGTJ-UHFFFAOYSA-N

Chemical Property Profile of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone

XLogP
3.8
TPSA (Topological Polar Surface Area)
69.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
25
Complexity
490.0
Exact Mass
359.10367
Monoisotopic Mass
359.10367
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone

The XLogP value of 3.8 indicates that [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone. Following Lipinski's Rule of Five, [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone 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

What is the CAS number of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone?

The CAS number of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone is 347313-62-6.

What is the molecular formula of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone?

The molecular formula of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone is C18H18ClN3O3.

What is the molecular weight of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone?

The molecular weight of [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone is 359.10367 g/mol.

Where can I buy [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone?

You can request a quote for [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone?

Yes, CoreyChem provides custom synthesis services for [4-(2-Chloro-6-nitrophenyl)piperazin-1-yl]-(3-methylphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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