(4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
TL;DR: (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone (CAS 329940-45-6) is a chemical compound with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
Also Known As: BAS 00500960, (4-methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone, AB00082630-01, 1-(4-METHYL-3-NITROBENZOYL)-4-PHENYLPIPERAZINE, 4-methyl-3-nitrophenyl 4-phenylpiperazinyl ketone
| Molecular Formula | C18H19N3O3 |
|---|---|
| Molecular Weight | 325.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.14264 |
| Heavy Atoms | 24 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 329940-45-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-] |
| InChIKey | NTOPHDBXYBJYBL-UHFFFAOYSA-N |
Product Overview
(4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone (CAS 329940-45-6), with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol. IUPAC: (4-methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone.
Chemical Property Profile of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
Property Insights of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone
The XLogP value of 3.2 indicates that (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)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-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone. Following Lipinski's Rule of Five, (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)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
Frequently Asked Questions
What is the CAS number of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
The CAS number of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone is 329940-45-6.
What is the molecular formula of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
The molecular formula of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone is C18H19N3O3.
What is the molecular weight of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
The molecular weight of (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone is 325.14 g/mol.
Where can I buy (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
You can request a quote for (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Methyl-3-nitrophenyl)-(4-phenylpiperazin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.