AJ-190/13485012
TL;DR: AJ-190/13485012 (CAS 16771-89-4) is a chemical compound with molecular formula C15H21NO2 and molecular weight 247.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-phenylethyl)-1,4-dioxa-8-azaspiro[4.5]decane
Also Known As: 8-phenethyl-1,4-dioxa-8-azaspiro[4.5]decane, 8-(2-phenylethyl)-1,4-dioxa-8-azaspiro[4.5]decane, AJ-190/13485012, 1-Phenethylpiperidine-4-one ethylene acetal, 8-PHENETHYL-1,4-DIOXA-8-AZA-SPIRO[4.5]DECANE
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 2.068 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 363.3398 |
Chemical Identifiers
| CAS Number | 16771-89-4 |
|---|---|
| SMILES | C1CN(CCC12OCCO2)CCC3=CC=CC=C3 |
Product Overview
AJ-190/13485012 (CAS 16771-89-4), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: 8-(2-phenylethyl)-1,4-dioxa-8-azaspiro[4.5]decane.
Chemical Property Profile of AJ-190/13485012
Property Insights of AJ-190/13485012
The XLogP value of 2.068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AJ-190/13485012. With a topological polar surface area (TPSA) of 21.7 Ų, AJ-190/13485012 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AJ-190/13485012 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 AJ-190/13485012?
The CAS number of AJ-190/13485012 is 16771-89-4.
What is the molecular formula of AJ-190/13485012?
The molecular formula of AJ-190/13485012 is C15H21NO2.
What is the molecular weight of AJ-190/13485012?
The molecular weight of AJ-190/13485012 is 247.16 g/mol.
Where can I buy AJ-190/13485012?
You can request a quote for AJ-190/13485012 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-190/13485012?
Yes, KEHONG BIO provides custom synthesis services for AJ-190/13485012 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.