![3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one structure](/static/products/1005/1005085-48-2.webp)
3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one
TL;DR: 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one (CAS 1005085-48-2) is a chemical compound with molecular formula C16H25BrN2O2 and molecular weight 356.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-1,7,7-trimethyl-4-(4-methylpiperazine-1-carbonyl)bicyclo[2.2.1]heptan-2-one
Also Known As: 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one, 3-bromo-1,7,7-trimethyl-4-(4-methylpiperazine-1-carbonyl)bicyclo[2.2.1]heptan-2-one, 3-Bromo-1,7,7-trimethyl-4-(4-methyl-piperazine-1-carbonyl)-bicyclo[2.2.1]heptan-2-one, 3-bromo-1,7,7-trimethyl-4-[(4-methylpiperazin-1-yl)carbonyl]bicyclo[2.2.1]heptan-2-one, 3-bromo-1,7,7-trimethyl-4-[(4-methylpiperazinyl)carbonyl]bicyclo[2.2.1]heptan- 2-one
| Molecular Formula | C16H25BrN2O2 |
|---|---|
| Molecular Weight | 356.11 g/mol |
| LogP | 1.9193 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 356.10995 |
| Heavy Atoms | 21 |
| Complexity | 498.50543 |
Chemical Identifiers
| CAS Number | 1005085-48-2 |
|---|---|
| SMILES | CC1(C2(CCC1(C(C2=O)Br)C(=O)N3CCN(CC3)C)C)C |
Product Overview
3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one (CAS 1005085-48-2), with molecular formula C16H25BrN2O2 and molecular weight 356.11 g/mol. IUPAC: 3-bromo-1,7,7-trimethyl-4-(4-methylpiperazine-1-carbonyl)bicyclo[2.2.1]heptan-2-one.
Chemical Property Profile of 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one
Property Insights of 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one
The XLogP value of 1.9193 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one. With a topological polar surface area (TPSA) of 40.62 Ų, 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one 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 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one?
The CAS number of 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one is 1005085-48-2.
What is the molecular formula of 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one?
The molecular formula of 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one is C16H25BrN2O2.
What is the molecular weight of 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one?
The molecular weight of 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one is 356.11 g/mol.
Where can I buy 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one?
You can request a quote for 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-1,7,7-trimethyl-4-[(4-methyl-1-piperazinyl)carbonyl]bicyclo[2.2.1]heptan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.