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8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione structure
Fine Chemical

8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

TL;DR: 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione (CAS 127354-24-9) is a chemical compound with molecular formula C20H21N3O2 and molecular weight 335.1634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

8-benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

Also Known As: 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione, 8-benzyl-4-phenyl-2,4,8-triazaspiro[4.5]decane-1,3-dione, 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4,5]decane-2,4-dione, 1,3,8-triazaspiro[4.5]decane-2,4-dione, 1-phenyl-8-(phenylmethyl)-

CAS Number
127354-24-9
Molecular Formula
C20H21N3O2
Molecular Weight
335.1634 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (5 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC20H21N3O2
Molecular Weight335.1634 g/mol
XLogP2.6
Topological Polar Surface Area (TPSA)52.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds3
Exact Mass335.1634 Da
Heavy Atoms25
Complexity501.0
SMILESC1CN(CCC12C(=O)NC(=O)N2C3=CC=CC=C3)CC4=CC=CC=C4
InChIKeyHDUZKHOUCKGFEP-UHFFFAOYSA-N

Chemical Property Profile of 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

XLogP
2.6
TPSA (Topological Polar Surface Area)
52.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
3
Heavy Atoms
25
Complexity
501.0
Exact Mass
335.1634
Monoisotopic Mass
335.1634
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 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione

The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione. With a topological polar surface area (TPSA) of 52.7 Ų, 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione 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

What is the CAS number of 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?

The CAS number of 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is 127354-24-9.

What is the molecular formula of 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?

The molecular formula of 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is C20H21N3O2.

What is the molecular weight of 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?

The molecular weight of 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione is 335.1634 g/mol.

Where can I buy 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?

You can request a quote for 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione?

Yes, CoreyChem provides custom synthesis services for 8-Benzyl-1-phenyl-1,3,8-triazaspiro[4.5]decane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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