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23676-63-3 | Acetamide, N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-
CAS No: 23676-63-3 Catalog No: AG002O4I MDL No:MFCD09743972
Product Description
Catalog Number:
AG002O4I
Chemical Name:
Acetamide, N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-
CAS Number:
23676-63-3
Molecular Formula:
C8H12N4O
Molecular Weight:
180.2071
MDL Number:
MFCD09743972
IUPAC Name:
N-[(4-amino-2-methylpyrimidin-5-yl)methyl]acetamide
InChI:
InChI=1S/C8H12N4O/c1-5-10-3-7(8(9)12-5)4-11-6(2)13/h3H,4H2,1-2H3,(H,11,13)(H2,9,10,12)
InChI Key:
SXZFUSAWDLRCLQ-UHFFFAOYSA-N
SMILES:
CC(=O)NCc1cnc(nc1N)C
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.101g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.211g/mol
Monoisotopic Mass:
180.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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