1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine
TL;DR: 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine (CAS 80712-36-3) is a chemical compound with molecular formula C15H20Cl2N4O2 and molecular weight 358.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dichlorophenyl)-N-(dimethylcarbamoyl)-N-methylpiperazine-1-carboxamide
Also Known As: 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine, 1-Piperazinecarboxamide, 4-(3,4-dichlorophenyl)-N-((dimethylamino)carbonyl)-N-methyl-, 4-(3,4-Dichlorophenyl)-N-((dimethylamino)carbonyl)-N-methyl-1-piperazinecarboxamide, 4-(3,4-dichlorophenyl)-N-(dimethylcarbamoyl)-N-methylpiperazine-1-carboxamide, RefChem:233449
| Molecular Formula | C15H20Cl2N4O2 |
|---|---|
| Molecular Weight | 358.10 g/mol |
| LogP | 2.8488 |
| Topological Polar Surface Area | 47.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 358.09634 |
| Heavy Atoms | 23 |
| Complexity | 601.1397 |
Chemical Identifiers
| CAS Number | 80712-36-3 |
|---|---|
| SMILES | CN(C)C(=O)N(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)Cl)Cl |
Product Overview
1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine (CAS 80712-36-3), with molecular formula C15H20Cl2N4O2 and molecular weight 358.10 g/mol. IUPAC: 4-(3,4-dichlorophenyl)-N-(dimethylcarbamoyl)-N-methylpiperazine-1-carboxamide.
Chemical Property Profile of 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine
Property Insights of 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine
The XLogP value of 2.8488 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine. With a topological polar surface area (TPSA) of 47.1 Ų, 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine has 0 hydrogen bond donor(s) and 3 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-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine?
The CAS number of 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine is 80712-36-3.
What is the molecular formula of 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine?
The molecular formula of 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine is C15H20Cl2N4O2.
What is the molecular weight of 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine?
The molecular weight of 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine is 358.10 g/mol.
Where can I buy 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine?
You can request a quote for 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorophenyl)-4-(2,4,4-trimethylallophanoyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.