Nombre: 3-(2-bromo-phenyl)-3,4-dihydro-7-methanesulphonyl-1-methyl-pyrimido[4,5-d]pyrimidin-2(1H)-one
SMILES:
CN1C(=O)N(c2ccccc2Br)Cc2cnc(S(C)(=O)=O)nc21Molecular Processing
Molecular formula
C14H13BrN4O3S
Molecular weight
397.25
Exact mass
395.9892
XLogP
2.22
TPSA
83.47
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
89.27
Supplementary Information
Obteniendo detalles…
Participa en 5 reacciones→