이름: 6-Bromo-4′-methylspiro[chroman-4,2′-imidazole]-5′(1′H)-thione
SMILES:
CC1=NC2(CCOc3ccc(Br)cc32)NC1=SMolecular Processing
Molecular formula
C12H11BrN2OS
Molecular weight
311.2
Exact mass
309.9775
XLogP
2.78
TPSA
33.62
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
74.77
Supplementary Information
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