3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-
TL;DR: 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- (CAS 63990-34-1) is a chemical compound with molecular formula C10H16N2O3 and molecular weight 212.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)-2-oxoacetate
Also Known As: 8-Methoxydicarbonyl-3-methyl-3,8-diazabicyclo(3.2.1)octane, 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-, 8- -3-methyl-3,8-diazabicyclo[3.2.1]octane, methyl(3-methyl-3,8-diazabicyclo[3.2.1]oct-8-yl)(oxo)acetate, 8-(2-Methoxy-1,2-dioxoethyl)-3-methyl-3,8-diazabicyclo[3.2.1]octane
| Molecular Formula | C10H16N2O3 |
|---|---|
| Molecular Weight | 212.12 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.11609 |
| Heavy Atoms | 15 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 63990-34-1 |
|---|---|
| SMILES | CN1CC2CCC(C1)N2C(=O)C(=O)OC |
| InChIKey | BOKLXRSOBOAPTP-UHFFFAOYSA-N |
Product Overview
3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- (CAS 63990-34-1), with molecular formula C10H16N2O3 and molecular weight 212.12 g/mol. IUPAC: methyl 2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)-2-oxoacetate.
Chemical Property Profile of 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-
Property Insights of 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-. With a topological polar surface area (TPSA) of 49.9 Ų, 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- 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 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-?
The CAS number of 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- is 63990-34-1.
What is the molecular formula of 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-?
The molecular formula of 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- is C10H16N2O3.
What is the molecular weight of 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-?
The molecular weight of 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- is 212.12 g/mol.
Where can I buy 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-?
You can request a quote for 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3,8-Diazabicyclo(3.2.1)octane, 8-methoxydicarbonyl-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.