cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine
TL;DR: cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine (CAS 153747-81-0) is a chemical compound with molecular formula C12H17N3O2 and molecular weight 235.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,5S)-3,5-dimethyl-1-(4-nitrophenyl)piperazine
Also Known As: cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine, BAS 00253719, rel-(3S,5R)-3,5-Dimethyl-1-(4-nitrophenyl)piperazine, (3R,5S)-3,5-dimethyl-1-(4-nitrophenyl)piperazine, Cis-3,5-dimethyl-1-(4-nitro-phenyl)-piperazine
Technical Specifications
| Molecular Formula | C12H17N3O2 |
| Molecular Weight | 235.13208 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 61.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.13208 Da |
| Heavy Atoms | 17 |
| Complexity | 261.0 |
| SMILES | C[C@@H]1CN(C[C@@H](N1)C)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | UBLZWKCJZSDBGQ-AOOOYVTPSA-N |
Chemical Property Profile of cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine
Property Insights of cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine. The TPSA of 61.1 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine. Following Lipinski's Rule of Five, cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine has 1 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 cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine?
The CAS number of cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine is 153747-81-0.
What is the molecular formula of cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine?
The molecular formula of cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine is C12H17N3O2.
What is the molecular weight of cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine?
The molecular weight of cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine is 235.13208 g/mol.
Where can I buy cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine?
You can request a quote for cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine?
Yes, CoreyChem provides custom synthesis services for cis-3,5-Dimethyl-1-(4-nitrophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.