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Home > Pyridines > 1465984-90-0
1465984-90-0 | 2-(4-methylpiperazin-1-yl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidin-4-one
CAS No: 1465984-90-0 Catalog No: AG01C3UD MDL No:MFCD19019967
Product Description
Catalog Number:
AG01C3UD
Chemical Name:
2-(4-methylpiperazin-1-yl)-3H,4H,5H,6H,7H,8H-pyrido[2,3-d]pyrimidin-4-one
CAS Number:
1465984-90-0
Molecular Formula:
C12H19N5O
Molecular Weight:
249.3122
MDL Number:
MFCD19019967
IUPAC Name:
2-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C12H19N5O/c1-16-5-7-17(8-6-16)12-14-10-9(11(18)15-12)3-2-4-13-10/h2-8H2,1H3,(H2,13,14,15,18)
InChI Key:
ICYDZEHMWVMIQV-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1nc2NCCCc2c(=O)[nH]1
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.159g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.318g/mol
Monoisotopic Mass:
249.159g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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