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Home > Other Heterocycles > 189333-48-0
189333-48-0 | 3,9-Diazaspiro[5.5]undecane-2,4-dione, 9-(phenylmethyl)-
CAS No: 189333-48-0 Catalog No: AG002IB4 MDL No:MFCD11040245
Product Description
Catalog Number:
AG002IB4
Chemical Name:
3,9-Diazaspiro[5.5]undecane-2,4-dione, 9-(phenylmethyl)-
CAS Number:
189333-48-0
Molecular Formula:
C16H20N2O2
Molecular Weight:
272.3422
MDL Number:
MFCD11040245
IUPAC Name:
9-benzyl-3,9-diazaspiro[5.5]undecane-2,4-dione
InChI:
InChI=1S/C16H20N2O2/c19-14-10-16(11-15(20)17-14)6-8-18(9-7-16)12-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,17,19,20)
InChI Key:
MZOUQZZYZKEBKL-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)CC2(C1)CCN(CC2)Cc1ccccc1
NSC Number:
116044
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.152g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.348g/mol
Monoisotopic Mass:
272.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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