Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-
TL;DR: Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- (CAS 101913-95-5) is a chemical compound with molecular formula C21H30N4O and molecular weight 354.24197 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decan-8-yl)heptanenitrile
Also Known As: HEPTANONITRILE, 7-(3-METHYL-4-OXO-1-PHENYL-1,3,8-TRIAZASPIRO(4.5)DEC-8-YL)-, 8-(6-Cyanohexyl)-3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)decane, 7-(3-Methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-8-yl)heptanenitrile, 8-(6-Cyanohexyl)-3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane
Technical Specifications
| Molecular Formula | C21H30N4O |
| Molecular Weight | 354.24197 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 354.24197 Da |
| Heavy Atoms | 26 |
| Complexity | 511.0 |
| SMILES | CN1CN(C2(C1=O)CCN(CC2)CCCCCCC#N)C3=CC=CC=C3 |
| InChIKey | GDFRSJQALJTCDV-UHFFFAOYSA-N |
Chemical Property Profile of Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-
Property Insights of Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-
The XLogP value of 3.1 indicates that Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- has 0 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 Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-?
The CAS number of Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- is 101913-95-5.
What is the molecular formula of Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-?
The molecular formula of Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- is C21H30N4O.
What is the molecular weight of Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-?
The molecular weight of Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- is 354.24197 g/mol.
Where can I buy Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-?
You can request a quote for Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)-?
Yes, CoreyChem provides custom synthesis services for Heptanonitrile, 7-(3-methyl-4-oxo-1-phenyl-1,3,8-triazaspiro(4.5)dec-8-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.