Br.COCCCn1c(=N)sc2ccccc21
SMILES: Br.COCCCn1c(=N)sc2ccccc21

Molecular Processing

Molecular formula
C11H15BrN2OS
Molecular weight
303.23
Exact mass
302.0088
XLogP
2.8
TPSA
38.01
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.364
Molar refractivity
72.48

Supplementary Information

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