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Home > Other Heterocycles > 950-31-2
950-31-2 | Spiro[cyclohexane-1,2'(1'H)-quinazolin]-4'(3'H)-one
CAS No: 950-31-2 Catalog No: AG00IIOP MDL No:MFCD02029491
Product Description
Catalog Number:
AG00IIOP
Chemical Name:
Spiro[cyclohexane-1,2'(1'H)-quinazolin]-4'(3'H)-one
CAS Number:
950-31-2
MDL Number:
MFCD02029491
IUPAC Name:
spiro[1,3-dihydroquinazoline-2,1'-cyclohexane]-4-one
InChI:
InChI=1S/C13H16N2O/c16-12-10-6-2-3-7-11(10)14-13(15-12)8-4-1-5-9-13/h2-3,6-7,14H,1,4-5,8-9H2,(H,15,16)
InChI Key:
LUDINISIACCKKZ-UHFFFAOYSA-N
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.284g/mol
Monoisotopic Mass:
216.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Synthesis, biological evaluation and molecular docking of novel series of spiro [(2H,3H) quinazoline-2,1'- cyclohexan]-4(1H)- one derivatives as anti-inflammatory and analgesic agents. | European journal of medicinal chemistry 20100601 |
| Cyclo-hexa-nespiro-2'-[2',3',6',7'-tetra-hydro-1'H-cyclo-penta-[d]pyrimidin]-4'(5'H)-one. | Acta crystallographica. Section E, Structure reports online 20090301 |
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