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Home > Other Heterocycles > 138402-05-8
138402-05-8 | 1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-
CAS No: 138402-05-8 Catalog No: AG0018Q9 MDL No:MFCD03411590
Product Description
Catalog Number:
AG0018Q9
Chemical Name:
1,3-Diazaspiro[4.4]non-1-en-4-one, 2-butyl-
CAS Number:
138402-05-8
Molecular Formula:
C11H18N2O
Molecular Weight:
194.2734
MDL Number:
MFCD03411590
IUPAC Name:
2-butyl-1,3-diazaspiro[4.4]non-1-en-4-one
InChI:
InChI=1S/C11H18N2O/c1-2-3-6-9-12-10(14)11(13-9)7-4-5-8-11/h2-8H2,1H3,(H,12,13,14)
InChI Key:
IWKWOYOVCXHXSS-UHFFFAOYSA-N
SMILES:
CCCCC1=NC2(C(=O)N1)CCCC2
EC Number:
604-076-1
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.278g/mol
Monoisotopic Mass:
194.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Synthesis and screening for acetylcholinesterase inhibitor activity of some novel 2-butyl-1,3-diaza-spiro[4,4]non-1-en-4-ones: derivatives of irbesartan key intermediate. | Bioorganic & medicinal chemistry 20071201 |
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