Home Other Building Blocks 2-methyl-5, 6, 7, 8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one

2-methyl-5, 6, 7, 8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one

CAS No.:
62259-95-4
Catalog Number:
AG00ECG0
Molecular Formula:
C8H11N3O
Molecular Weight:
165.1924
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Product Description
Catalog Number:
AG00ECG0
Chemical Name:
2-methyl-5, 6, 7, 8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one
CAS Number:
62259-95-4
Molecular Formula:
C8H11N3O
Molecular Weight:
165.1924
MDL Number:
MFCD14636171
IUPAC Name:
2-methyl-5,6,7,8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one
InChI:
InChI=1S/C8H11N3O/c1-5-10-7-4-9-3-2-6(7)8(12)11-5/h9H,2-4H2,1H3,(H,10,11,12)
InChI Key:
YYZKKLJMPSCJHD-UHFFFAOYSA-N
SMILES:
Cc1nc2CNCCc2c(=O)[nH]1
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.196g/mol
Monoisotopic Mass:
165.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3  
Properties