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Home > Other Heterocycles > 202826-52-6
202826-52-6 | Spiro[piperidine-4,2'(1'H)-quinazolin]-4'(3'H)-one
CAS No: 202826-52-6 Catalog No: AG0028H2 MDL No:MFCD11049641
Product Description
Catalog Number:
AG0028H2
Chemical Name:
Spiro[piperidine-4,2'(1'H)-quinazolin]-4'(3'H)-one
CAS Number:
202826-52-6
Molecular Formula:
C12H15N3O
Molecular Weight:
217.2670
MDL Number:
MFCD11049641
IUPAC Name:
spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one
InChI:
InChI=1S/C12H15N3O/c16-11-9-3-1-2-4-10(9)14-12(15-11)5-7-13-8-6-12/h1-4,13-14H,5-8H2,(H,15,16)
InChI Key:
DMCVIPFZUCHMQV-UHFFFAOYSA-N
SMILES:
O=C1NC2(CCNCC2)Nc2c1cccc2
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.122g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
217.272g/mol
Monoisotopic Mass:
217.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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