![4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile structure](/static/products/978/97841-67-3.png)
4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile
TL;DR: 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile (CAS 97841-67-3) is a chemical compound with molecular formula C17H11N5O2 and molecular weight 317.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-amino-4-methyl-1-oxo-6-phenyl-2-oxa-3-azaspiro[4.4]nona-3,8-diene-7,7,8-tricarbonitrile
Also Known As: 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile, 9-amino-4-methyl-1-oxo-6-phenyl-2-oxa-3-azaspiro[4.4]nona-3,8-diene-7,7,8-tricarbonitrile, 3-methyl-5-oxo-2'-amino-5'-phenyl -3',4',4'-tricyanoisoxazoline-4-spiro-1'-cyclopent-2'-ene
| Molecular Formula | C17H11N5O2 |
|---|---|
| Molecular Weight | 317.09 g/mol |
| LogP | 1.47284 |
| Topological Polar Surface Area | 136.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 317.09128 |
| Heavy Atoms | 24 |
| Complexity | 912.45807 |
Chemical Identifiers
| CAS Number | 97841-67-3 |
|---|---|
| SMILES | CC1=NOC(=O)C12C(C(C(=C2N)C#N)(C#N)C#N)C3=CC=CC=C3 |
Product Overview
4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile (CAS 97841-67-3), with molecular formula C17H11N5O2 and molecular weight 317.09 g/mol. IUPAC: 9-amino-4-methyl-1-oxo-6-phenyl-2-oxa-3-azaspiro[4.4]nona-3,8-diene-7,7,8-tricarbonitrile.
Chemical Property Profile of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile
Property Insights of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile
The XLogP value of 1.47284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile. The TPSA of 136.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile. Following Lipinski's Rule of Five, 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile?
The CAS number of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile is 97841-67-3.
What is the molecular formula of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile?
The molecular formula of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile is C17H11N5O2.
What is the molecular weight of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile?
The molecular weight of 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile is 317.09 g/mol.
Where can I buy 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile?
You can request a quote for 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-6-methyl-9-oxo-1-phenyl-8-oxa-7-azaspiro[4.4]nona-3,6-diene-2,2,3-tricarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.