이름: 2-(1-azidopropyl)-3-iodo-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
SMILES:
CCC(N=[N+]=[N-])c1nc2cccc(C)n2c(=O)c1IMolecular Processing
Molecular formula
C12H12IN5O
Molecular weight
369.17
Exact mass
369.0087
XLogP
3.37
TPSA
83.13
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
81.09
Supplementary Information
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