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3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane structure
Fine Chemical

3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane

TL;DR: 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane (CAS 63977-93-5) is a chemical compound with molecular formula C19H26N2O and molecular weight 298.2045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[3-(4-phenylbut-3-enyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one

Also Known As: 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane

CAS Number
63977-93-5
Molecular Formula
C19H26N2O
Molecular Weight
298.2045 g/mol
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Technical Specifications

Molecular FormulaC19H26N2O
Molecular Weight298.2045 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)23.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds5
Exact Mass298.2045 Da
Heavy Atoms22
Complexity386.0
SMILESCCC(=O)N1C2CCC1CN(C2)CCC=CC3=CC=CC=C3
InChIKeyDJEUWFADFGMDAH-UHFFFAOYSA-N

Chemical Property Profile of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane

XLogP
3.2
TPSA (Topological Polar Surface Area)
23.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
5
Heavy Atoms
22
Complexity
386.0
Exact Mass
298.2045
Monoisotopic Mass
298.2045
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane

The XLogP value of 3.2 indicates that 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane?

The CAS number of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane is 63977-93-5.

What is the molecular formula of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane?

The molecular formula of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane is C19H26N2O.

What is the molecular weight of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane?

The molecular weight of 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane is 298.2045 g/mol.

Where can I buy 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane?

You can request a quote for 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane?

Yes, CoreyChem provides custom synthesis services for 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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