J1.713.280F
TL;DR: J1.713.280F (CAS 397849-97-7) 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.
[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-1-[(1R)-1-phenylethyl]aziridine-2-carboxylate
Also Known As: J1.713.280F, [(1R,2S,5R)-5-Methyl-2-propan-2-ylcyclohexyl] (2S)-1-[(1R)-1-phenylethyl]aziridine-2-carboxylate, (-)-Menthyl (S)-1-[(R)-, A-methylbenzyl]aziridine-2-carboxylate, (-)-Menthyl (S)-1-[(R)-alpha-methylbenzyl]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 | 397849-97-7 |
|---|---|
| SMILES | C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@@H]2CN2[C@H](C)C3=CC=CC=C3)C(C)C |
Product Overview
J1.713.280F (CAS 397849-97-7), with molecular formula C21H31NO2 and molecular weight 329.24 g/mol. IUPAC: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (2S)-1-[(1R)-1-phenylethyl]aziridine-2-carboxylate.
Chemical Property Profile of J1.713.280F
Property Insights of J1.713.280F
The XLogP value of 4.4358 indicates that J1.713.280F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.31 Ų, J1.713.280F exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J1.713.280F 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 J1.713.280F?
The CAS number of J1.713.280F is 397849-97-7.
What is the molecular formula of J1.713.280F?
The molecular formula of J1.713.280F is C21H31NO2.
What is the molecular weight of J1.713.280F?
The molecular weight of J1.713.280F is 329.24 g/mol.
Where can I buy J1.713.280F?
You can request a quote for J1.713.280F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.713.280F?
Yes, KEHONG BIO provides custom synthesis services for J1.713.280F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.