Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester
TL;DR: Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester (CAS 23111-68-4) is a chemical compound with molecular formula C16H25N3O2 and molecular weight 291.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-(4-benzylpiperazin-1-yl)ethyl]carbamate
Also Known As: N-[2- ethyl]carbamicacidethylester, 1-(2-Carbaethoxaminoaethyl)-4-benzylpiperazin, 5-23-01-00295 (Beilstein Handbook Reference), 1-(2-Carbaethoxaminoaethyl)-4-benzylpiperazin [German], CARBAMIC ACID, (2-(4-BENZYL-1-PIPERAZINYL)ETHYL)-, ETHYL ESTER
| Molecular Formula | C16H25N3O2 |
|---|---|
| Molecular Weight | 291.19 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.19467 |
| Heavy Atoms | 21 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 23111-68-4 |
|---|---|
| SMILES | CCOC(=O)NCCN1CCN(CC1)CC2=CC=CC=C2 |
| InChIKey | KWISGZYDAAJRCN-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester (CAS 23111-68-4), with molecular formula C16H25N3O2 and molecular weight 291.19 g/mol. IUPAC: ethyl N-[2-(4-benzylpiperazin-1-yl)ethyl]carbamate.
Chemical Property Profile of Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester
Property Insights of Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester. With a topological polar surface area (TPSA) of 44.8 Ų, Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl 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 Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester?
The CAS number of Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester is 23111-68-4.
What is the molecular formula of Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester?
The molecular formula of Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester is C16H25N3O2.
What is the molecular weight of Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester?
The molecular weight of Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester is 291.19 g/mol.
Where can I buy Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester?
You can request a quote for Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (2-(4-benzyl-1-piperazinyl)ethyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.