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1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione structure
Fine Chemical

1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione

TL;DR: 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione (CAS 110927-31-6) is a chemical compound with molecular formula C18H25N3O3 and molecular weight 331.1896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[2-(diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione

Also Known As: Hexamid, 1-Diethylaminoethylphenobarbital, 1-(2-Diethylaminoethyl)phenobarbital, F 156, F-156

CAS Number
110927-31-6
Molecular Formula
C18H25N3O3
Molecular Weight
331.1896 g/mol
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Technical Specifications

Molecular FormulaC18H25N3O3
Molecular Weight331.1896 g/mol
XLogP2.6
Topological Polar Surface Area (TPSA)69.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds7
Exact Mass331.1896 Da
Heavy Atoms24
Complexity484.0
SMILESCCC1(C(=O)NC(=O)N(C1=O)CCN(CC)CC)C2=CC=CC=C2
InChIKeyJPSKYEDINNEHEB-UHFFFAOYSA-N

Chemical Property Profile of 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione

XLogP
2.6
TPSA (Topological Polar Surface Area)
69.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
7
Heavy Atoms
24
Complexity
484.0
Exact Mass
331.1896
Monoisotopic Mass
331.1896
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 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione

The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione?

The CAS number of 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione is 110927-31-6.

What is the molecular formula of 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione?

The molecular formula of 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione is C18H25N3O3.

What is the molecular weight of 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione?

The molecular weight of 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione is 331.1896 g/mol.

Where can I buy 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione?

You can request a quote for 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione?

Yes, CoreyChem provides custom synthesis services for 1-[2-(Diethylamino)ethyl]-5-ethyl-5-phenyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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