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Home > Imidazoles > 1042651-11-5
1042651-11-5 | 4-(piperazine-1-carbonyl)-2,3-dihydro-1H-imidazol-2-one
CAS No: 1042651-11-5 Catalog No: AG01ABJL MDL No:MFCD11172550
Product Description
Catalog Number:
AG01ABJL
Chemical Name:
4-(piperazine-1-carbonyl)-2,3-dihydro-1H-imidazol-2-one
CAS Number:
1042651-11-5
Molecular Formula:
C8H12N4O2
Molecular Weight:
196.2065
MDL Number:
MFCD11172550
IUPAC Name:
4-(piperazine-1-carbonyl)-1,3-dihydroimidazol-2-one
InChI:
InChI=1S/C8H12N4O2/c13-7(6-5-10-8(14)11-6)12-3-1-9-2-4-12/h5,9H,1-4H2,(H2,10,11,14)
InChI Key:
GYQUWAASFPLFRT-UHFFFAOYSA-N
SMILES:
O=C(c1c[nH]c(=O)[nH]1)N1CCNCC1
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.096g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
196.21g/mol
Monoisotopic Mass:
196.096g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
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