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1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- structure
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1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-

TL;DR: 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- (CAS 111964-37-5) is a chemical compound with molecular formula C14H18N2O and molecular weight 230.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-benzyl-1,3-diazaspiro[4.4]nonan-2-one

Also Known As: 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-, TT-54-82, 1-Benzyl-1,3-diazaspiro(4.4)nonan-2-one, 1-Benzylo-5,5-tetrametylenoimidazolidynon-2, 1-Benzylo-5,5-tetrametylenoimidazolidynon-2 [Polish]

CAS Number
111964-37-5
Molecular Formula
C14H18N2O
Molecular Weight
230.1419 g/mol
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Technical Specifications

Molecular FormulaC14H18N2O
Molecular Weight230.1419 g/mol
XLogP1.9
Topological Polar Surface Area (TPSA)32.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors1
Rotatable Bonds2
Exact Mass230.1419 Da
Heavy Atoms17
Complexity291.0
SMILESC1CCC2(C1)CNC(=O)N2CC3=CC=CC=C3
InChIKeyXUGFIAZILZFJSS-UHFFFAOYSA-N

Chemical Property Profile of 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-

XLogP
1.9
TPSA (Topological Polar Surface Area)
32.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Rotatable Bonds
2
Heavy Atoms
17
Complexity
291.0
Exact Mass
230.1419
Monoisotopic Mass
230.1419
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 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-

The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-. With a topological polar surface area (TPSA) of 32.3 Ų, 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-?

The CAS number of 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- is 111964-37-5.

What is the molecular formula of 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-?

The molecular formula of 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- is C14H18N2O.

What is the molecular weight of 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-?

The molecular weight of 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- is 230.1419 g/mol.

Where can I buy 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-?

You can request a quote for 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl-?

Yes, CoreyChem provides custom synthesis services for 1,3-Diazaspiro(4.4)nonan-2-one, 1-benzyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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