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126354-30-1 | Benzamide,N-(2,3-dihydro-5-methyl-2-oxo-4-pyrimidinyl)-
CAS No: 126354-30-1 Catalog No: AG000SP6 MDL No:
Product Description
Catalog Number:
AG000SP6
Chemical Name:
Benzamide,N-(2,3-dihydro-5-methyl-2-oxo-4-pyrimidinyl)-
CAS Number:
126354-30-1
Molecular Formula:
C12H11N3O2
Molecular Weight:
229.2346
IUPAC Name:
N-(5-methyl-2-oxo-1H-pyrimidin-6-yl)benzamide
InChI:
InChI=1S/C12H11N3O2/c1-8-7-13-12(17)15-10(8)14-11(16)9-5-3-2-4-6-9/h2-7H,1H3,(H2,13,14,15,16,17)
InChI Key:
FMKLITBCOZWOEX-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Nc1[nH]c(=O)ncc1C
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.239g/mol
Monoisotopic Mass:
229.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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