1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-
TL;DR: 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- (CAS 2940-60-5) is a chemical compound with molecular formula C22H27N3O and molecular weight 349.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[1-(4-methylphenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Also Known As: 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-, 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(1-(4-methylphenyl)ethyl)-1-phenyl-, 8-(alpha,p-Dimethylbenzyl)-1-phenyl-1,3,8-triazaspiro(4.5)decan-4-one, D,L-1-Phenyl-4-oxo-8-(1-(4-methylphenyl)ethyl)-1,3,8-triazaspiro(4.5)decane, 8-[1-(4-methylphenyl)ethyl]-4-phenyl-2,4,8-triazaspiro[4.5]decan-1-one
| Molecular Formula | C22H27N3O |
|---|---|
| Molecular Weight | 349.22 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.21542 |
| Heavy Atoms | 26 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 2940-60-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C)N2CCC3(CC2)C(=O)NCN3C4=CC=CC=C4 |
| InChIKey | MBCUBRXUURKNCY-UHFFFAOYSA-N |
Product Overview
1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- (CAS 2940-60-5), with molecular formula C22H27N3O and molecular weight 349.22 g/mol. IUPAC: 8-[1-(4-methylphenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one.
Chemical Property Profile of 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-
Property Insights of 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-
The XLogP value of 3.5 indicates that 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.6 Ų, 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- 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 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-?
The CAS number of 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- is 2940-60-5.
What is the molecular formula of 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-?
The molecular formula of 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- is C22H27N3O.
What is the molecular weight of 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-?
The molecular weight of 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- is 349.22 g/mol.
Where can I buy 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-?
You can request a quote for 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(alpha,p-dimethylbenzyl)-1-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.