Brn 2109071
TL;DR: Brn 2109071 (CAS 2589-18-6) is a chemical compound with molecular formula C11H20N2O4 and molecular weight 244.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(carbamoyloxymethyl)-2-methylpentyl] N-ethenylcarbamate
Also Known As: 2-[(carbamoyloxy)methyl]-2-methylpentyl vinylcarbamate, 2-Methyl-2-propyl-1,3-propanediol carbamate vinylcarbamate, 1,3-Propanediol, 2-methyl-2-propyl-, carbamate, vinylcarbamate, 2-(Carbamoyloxymethyl)-2-methylpentyl=vinylcarbamate, n-butyl-n-(phenylcarbamoyl)piperidine-1-carboxamide
| Molecular Formula | C11H20N2O4 |
|---|---|
| Molecular Weight | 244.14 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 90.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 244.1423 |
| Heavy Atoms | 17 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 2589-18-6 |
|---|---|
| SMILES | CCCC(C)(COC(=O)N)COC(=O)NC=C |
| InChIKey | QMTWOKBKQQYFPK-UHFFFAOYSA-N |
Product Overview
Brn 2109071 (CAS 2589-18-6), with molecular formula C11H20N2O4 and molecular weight 244.14 g/mol. IUPAC: [2-(carbamoyloxymethyl)-2-methylpentyl] N-ethenylcarbamate.
Chemical Property Profile of Brn 2109071
Property Insights of Brn 2109071
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Brn 2109071. The TPSA of 90.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Brn 2109071. Following Lipinski's Rule of Five, Brn 2109071 has 2 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 Brn 2109071?
The CAS number of Brn 2109071 is 2589-18-6.
What is the molecular formula of Brn 2109071?
The molecular formula of Brn 2109071 is C11H20N2O4.
What is the molecular weight of Brn 2109071?
The molecular weight of Brn 2109071 is 244.14 g/mol.
Where can I buy Brn 2109071?
You can request a quote for Brn 2109071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brn 2109071?
Yes, KEHONG BIO provides custom synthesis services for Brn 2109071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.