8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane
TL;DR: 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane (CAS 102395-59-5) is a chemical compound with molecular formula C24H29N3O4 and molecular weight 423.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(5-ethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Also Known As: 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane, 1,3,8-Triazaspiro(4.5)decan-4-one, 8-(8-ethoxy-1,4-benzodioxan-2-ylmethyl)-1-phenyl-, 1,3,8-Triazaspiro[4.5]decan-4-one,8-[(8-ethoxy-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-1-phenyl-, 1,3,8-Triazaspiro[4.5]decan-4-one,8-[(8-ethoxy-2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-1-phenyl, 8-[(5-ethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
| Molecular Formula | C24H29N3O4 |
|---|---|
| Molecular Weight | 423.22 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.21582 |
| Heavy Atoms | 31 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 102395-59-5 |
|---|---|
| SMILES | CCOC1=CC=CC2=C1OC(CO2)CN3CCC4(CC3)C(=O)NCN4C5=CC=CC=C5 |
| InChIKey | SGYOPRMRWBLBLQ-UHFFFAOYSA-N |
Product Overview
8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane (CAS 102395-59-5), with molecular formula C24H29N3O4 and molecular weight 423.22 g/mol. IUPAC: 8-[(5-ethoxy-2,3-dihydro-1,4-benzodioxin-3-yl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one.
Chemical Property Profile of 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane
Property Insights of 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane
The XLogP value of 3.5 indicates that 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane. Following Lipinski's Rule of Five, 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane has 1 hydrogen bond donor(s) and 6 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 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane?
The CAS number of 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane is 102395-59-5.
What is the molecular formula of 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane?
The molecular formula of 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane is C24H29N3O4.
What is the molecular weight of 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane?
The molecular weight of 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane is 423.22 g/mol.
Where can I buy 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane?
You can request a quote for 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane?
Yes, KEHONG BIO provides custom synthesis services for 8-(8-Ethoxy-1,4-benzodioxan-2-ylmethyl)-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.