이름: 1-(4-Methoxy-phenyl)-cyclopropanecarboxylic acid (5-bromo-thiazol-2-yl)-amide
SMILES:
COc1ccc(C2(C(=O)Nc3ncc(Br)s3)CC2)cc1Molecular Processing
Molecular formula
C14H13BrN2O2S
Molecular weight
353.24
Exact mass
351.9881
XLogP
3.58
TPSA
51.22
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
82.35
Supplementary Information
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