4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester
TL;DR: 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester (CAS 429629-04-9) is a chemical compound with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(naphthalene-2-carbonyl)piperazine-1-carboxylate
Also Known As: BAS 08979227, Ethyl 4-(2-naphthoyl)piperazine-1-carboxylate, ethyl 4-(2-naphthylcarbonyl)piperazinecarboxylate, ethyl 4-(naphthalene-2-carbonyl)piperazine-1-carboxylate, 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester
| Molecular Formula | C18H20N2O3 |
|---|---|
| Molecular Weight | 312.15 g/mol |
| LogP | 2.7541 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.1474 |
| Heavy Atoms | 23 |
| Complexity | 721.0334 |
Chemical Identifiers
| CAS Number | 429629-04-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3C=C2 |
Product Overview
4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester (CAS 429629-04-9), with molecular formula C18H20N2O3 and molecular weight 312.15 g/mol. IUPAC: ethyl 4-(naphthalene-2-carbonyl)piperazine-1-carboxylate.
Chemical Property Profile of 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester
Property Insights of 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester
The XLogP value of 2.7541 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester. With a topological polar surface area (TPSA) of 49.85 Ų, 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester has 0 hydrogen bond donor(s) and 3 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 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester?
The CAS number of 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester is 429629-04-9.
What is the molecular formula of 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester?
The molecular formula of 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester is C18H20N2O3.
What is the molecular weight of 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester?
The molecular weight of 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester is 312.15 g/mol.
Where can I buy 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester?
You can request a quote for 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-(Naphthalene-2-carbonyl)-piperazine-1-carboxylic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.