الاسم: (4-chloro-2-methylsulfanyl-pyrimidin-5-yl)-(2-isopropyl-4,5-dimethoxy-phenyl)-methanol
SMILES:
COc1cc(C(C)C)c(C(O)c2cnc(SC)nc2Cl)cc1OCMolecular Processing
Molecular formula
C17H21ClN2O3S
Molecular weight
368.89
Exact mass
368.0961
XLogP
4.07
TPSA
64.47
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
24
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
0.412
Molar refractivity
96.52
Supplementary Information
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