1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester
TL;DR: 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester (CAS 89019-22-7) is a chemical compound with molecular formula C6H10N2O2 and molecular weight 142.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1,6-diazabicyclo[3.1.0]hexane-5-carboxylate
Also Known As: Methyl 1,6-diazabicyclo[3.1.0]hexane-5-carboxylate, 5-Methoxycarbonyl-1,6-diazabicyclo[3.1.0]hexane, Methyl 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylate, 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester, 1,6-DIAZABICYCLO(3.1.0)HEXANE-5-CARBOXYLIC ACID-, METHYL ESTER
| Molecular Formula | C6H10N2O2 |
|---|---|
| Molecular Weight | 142.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 142.07423 |
| Heavy Atoms | 10 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 89019-22-7 |
|---|---|
| SMILES | COC(=O)C12CCCN1N2 |
| InChIKey | IXBSTSGUADVGCF-UHFFFAOYSA-N |
Product Overview
1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester (CAS 89019-22-7), with molecular formula C6H10N2O2 and molecular weight 142.07 g/mol. IUPAC: methyl 1,6-diazabicyclo[3.1.0]hexane-5-carboxylate.
Chemical Property Profile of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester
Property Insights of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester. With a topological polar surface area (TPSA) of 51.3 Ų, 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester 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
Frequently Asked Questions
What is the CAS number of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester?
The CAS number of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester is 89019-22-7.
What is the molecular formula of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester?
The molecular formula of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester is C6H10N2O2.
What is the molecular weight of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester?
The molecular weight of 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester is 142.07 g/mol.
Where can I buy 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester?
You can request a quote for 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1,6-Diazabicyclo(3.1.0)hexane-5-carboxylic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.