(5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate
TL;DR: (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate (CAS 397849-98-8) is a chemical compound with molecular formula C21H31NO2 and molecular weight 329.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate
Also Known As: ()-Menthyl (R)-1-[(R)-alpha-Methylbenzyl]aziridine-2-carboxylate, (5-methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate, [(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl] (2R)-1-[(1S)-1-phenylethyl]aziridine-2-carboxylate
| Molecular Formula | C21H31NO2 |
|---|---|
| Molecular Weight | 329.24 g/mol |
| LogP | 4.4358 |
| Topological Polar Surface Area | 29.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 329.23547 |
| Heavy Atoms | 24 |
| Complexity | 556.217 |
Chemical Identifiers
| CAS Number | 397849-98-8 |
|---|---|
| SMILES | CC1CCC(C(C1)OC(=O)C2CN2C(C)C3=CC=CC=C3)C(C)C |
Product Overview
(5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate (CAS 397849-98-8), with molecular formula C21H31NO2 and molecular weight 329.24 g/mol. IUPAC: (5-methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate.
Chemical Property Profile of (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate
Property Insights of (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate
The XLogP value of 4.4358 indicates that (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.31 Ų, (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate 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 (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate?
The CAS number of (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate is 397849-98-8.
What is the molecular formula of (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate?
The molecular formula of (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate is C21H31NO2.
What is the molecular weight of (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate?
The molecular weight of (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate is 329.24 g/mol.
Where can I buy (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate?
You can request a quote for (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (5-Methyl-2-propan-2-ylcyclohexyl) 1-(1-phenylethyl)aziridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.