Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-
TL;DR: Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- (CAS 107235-70-1) is a chemical compound with molecular formula C18H17N3O4 and molecular weight 339.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-(4-nitrobenzoyl)piperazin-2-one
Also Known As: Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-, 4-(4-Nitrobenzoyl)-1-(phenylmethyl)piperazinone, 1-benzyl-4-(4-nitrobenzoyl)piperazin-2-one, BRN 4568382, RefChem:372777
| Molecular Formula | C18H17N3O4 |
|---|---|
| Molecular Weight | 339.12 g/mol |
| LogP | 2.0794 |
| Topological Polar Surface Area | 83.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.12192 |
| Heavy Atoms | 25 |
| Complexity | 789.7283 |
Chemical Identifiers
| CAS Number | 107235-70-1 |
|---|---|
| SMILES | C1CN(C(=O)CN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3 |
Product Overview
Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- (CAS 107235-70-1), with molecular formula C18H17N3O4 and molecular weight 339.12 g/mol. IUPAC: 1-benzyl-4-(4-nitrobenzoyl)piperazin-2-one.
Chemical Property Profile of Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-
Property Insights of Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-
The XLogP value of 2.0794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-. The TPSA of 83.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-. Following Lipinski's Rule of Five, Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- 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 Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-?
The CAS number of Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- is 107235-70-1.
What is the molecular formula of Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-?
The molecular formula of Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- is C18H17N3O4.
What is the molecular weight of Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-?
The molecular weight of Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- is 339.12 g/mol.
Where can I buy Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-?
You can request a quote for Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Piperazinone, 4-(4-nitrobenzoyl)-1-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.