Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate
TL;DR: Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate (CAS 420099-14-5) is a chemical compound with molecular formula C18H29N3O3 and molecular weight 335.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate
Also Known As: BIM-0029032.P001, ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate, AO-080/40320071, ethyl 4-(N-adamantanylcarbamoyl)piperazinecarboxylate, ethyl 4-[(1-adamantylamino)carbonyl]-1-piperazinecarboxylate
| Molecular Formula | C18H29N3O3 |
|---|---|
| Molecular Weight | 335.22 g/mol |
| LogP | 2.4389 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 335.2209 |
| Heavy Atoms | 24 |
| Complexity | 478.35416 |
Chemical Identifiers
| CAS Number | 420099-14-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate (CAS 420099-14-5), with molecular formula C18H29N3O3 and molecular weight 335.22 g/mol. IUPAC: ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate
Property Insights of Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate
The XLogP value of 2.4389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate has 1 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 Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate?
The CAS number of Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate is 420099-14-5.
What is the molecular formula of Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate?
The molecular formula of Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate is C18H29N3O3.
What is the molecular weight of Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate?
The molecular weight of Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate is 335.22 g/mol.
Where can I buy Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate?
You can request a quote for Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(1-adamantylcarbamoyl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.