N-(2-Benzyloxyethyl)piperazin
TL;DR: N-(2-Benzyloxyethyl)piperazin (CAS 49810-14-2) is a chemical compound with molecular formula C13H21N5O6 and molecular weight 343.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[1,3-dimethyl-4-(methylamino)-2,6-dioxopyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate
Also Known As: N-(2-Benzyloxyethyl)piperazin, ethyl N-[1,3-dimethyl-4-(methylamino)-2,6-dioxopyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate, ethyl N-[1,3-dimethyl-4-(methylamino)-2,6-dioxopyrimidin-5-y, Diethyl 1-(1,3-dimethyl-6-(methylamino)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)hydrazine-1,2-dicarboxylate, Diethyl 1-[1,3-dimethyl-6-(methylamino)-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl]hydrazine-1,2-dicarboxylate
| Molecular Formula | C13H21N5O6 |
|---|---|
| Molecular Weight | 343.15 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 343.14917 |
| Heavy Atoms | 24 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 49810-14-2 |
|---|---|
| SMILES | CCOC(=O)NN(C1=C(N(C(=O)N(C1=O)C)C)NC)C(=O)OCC |
| InChIKey | RZMDBKCQMHXPMB-UHFFFAOYSA-N |
Product Overview
N-(2-Benzyloxyethyl)piperazin (CAS 49810-14-2), with molecular formula C13H21N5O6 and molecular weight 343.15 g/mol. IUPAC: ethyl N-[1,3-dimethyl-4-(methylamino)-2,6-dioxopyrimidin-5-yl]-N-(ethoxycarbonylamino)carbamate.
Chemical Property Profile of N-(2-Benzyloxyethyl)piperazin
Property Insights of N-(2-Benzyloxyethyl)piperazin
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Benzyloxyethyl)piperazin. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Benzyloxyethyl)piperazin. Following Lipinski's Rule of Five, N-(2-Benzyloxyethyl)piperazin has 2 hydrogen bond donor(s) and 7 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 N-(2-Benzyloxyethyl)piperazin?
The CAS number of N-(2-Benzyloxyethyl)piperazin is 49810-14-2.
What is the molecular formula of N-(2-Benzyloxyethyl)piperazin?
The molecular formula of N-(2-Benzyloxyethyl)piperazin is C13H21N5O6.
What is the molecular weight of N-(2-Benzyloxyethyl)piperazin?
The molecular weight of N-(2-Benzyloxyethyl)piperazin is 343.15 g/mol.
Where can I buy N-(2-Benzyloxyethyl)piperazin?
You can request a quote for N-(2-Benzyloxyethyl)piperazin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Benzyloxyethyl)piperazin?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Benzyloxyethyl)piperazin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.