1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine
TL;DR: 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine (CAS 545346-69-8) is a chemical compound with molecular formula C14H17N3O3 and molecular weight 275.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopropyl-[4-(4-nitrophenyl)piperazin-1-yl]methanone
Also Known As: 1-(cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine, UPCMLD0ENAT5775525:001, cyclopropyl 4-(4-nitrophenyl)piperazinyl ketone, cyclopropyl-[4-(4-nitrophenyl)piperazin-1-yl]methanone, cyclopropyl[4-(4-nitrophenyl)piperazin-1-yl]methanone
| Molecular Formula | C14H17N3O3 |
|---|---|
| Molecular Weight | 275.13 g/mol |
| LogP | 1.6534 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.12698 |
| Heavy Atoms | 20 |
| Complexity | 516.9706 |
Chemical Identifiers
| CAS Number | 545346-69-8 |
|---|---|
| SMILES | C1CC1C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine (CAS 545346-69-8), with molecular formula C14H17N3O3 and molecular weight 275.13 g/mol. IUPAC: cyclopropyl-[4-(4-nitrophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine
Property Insights of 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine
The XLogP value of 1.6534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine. Following Lipinski's Rule of Five, 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}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-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine?
The CAS number of 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine is 545346-69-8.
What is the molecular formula of 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine?
The molecular formula of 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine is C14H17N3O3.
What is the molecular weight of 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine?
The molecular weight of 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine is 275.13 g/mol.
Where can I buy 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine?
You can request a quote for 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(Cyclopropylcarbonyl)-4-{4-nitrophenyl}piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.