1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester
TL;DR: 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester (CAS 88732-40-5) is a chemical compound with molecular formula C11H22N2O3 and molecular weight 230.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3-methoxypropyl)piperazine-1-carboxylate
Also Known As: ethyl 4-(3-methoxypropyl)piperazine-1-carboxylate, AE-641/00335020, 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester, ethyl 4-(3-methoxypropyl)-1-piperazinecarboxylate
| Molecular Formula | C11H22N2O3 |
|---|---|
| Molecular Weight | 230.16 g/mol |
| LogP | 0.797 |
| Topological Polar Surface Area | 42.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 230.16304 |
| Heavy Atoms | 16 |
| Complexity | 203.40636 |
Chemical Identifiers
| CAS Number | 88732-40-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CCCOC |
Product Overview
1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester (CAS 88732-40-5), with molecular formula C11H22N2O3 and molecular weight 230.16 g/mol. IUPAC: ethyl 4-(3-methoxypropyl)piperazine-1-carboxylate.
Chemical Property Profile of 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester
Property Insights of 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester
The XLogP value of 0.797 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester. With a topological polar surface area (TPSA) of 42.01 Ų, 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester 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 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester?
The CAS number of 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester is 88732-40-5.
What is the molecular formula of 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester?
The molecular formula of 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester is C11H22N2O3.
What is the molecular weight of 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester?
The molecular weight of 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester is 230.16 g/mol.
Where can I buy 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester?
You can request a quote for 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinecarboxylic acid, 4-(3-methoxypropyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.