Name: 2,5-dichloro-N-[2-(propan-2-ylsulfonyl)phenyl]pyrimidin-4-amine
SMILES:
CC(C)S(=O)(=O)c1ccccc1Nc1nc(Cl)ncc1ClMolecular Processing
Molecular formula
C13H13Cl2N3O2S
Molecular weight
346.24
Exact mass
345.0106
XLogP
3.71
TPSA
71.95
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
84.1
Supplementary Information
Details werden geladen…
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