COc1cc(N)ccc1-c1nc2ccccc2s1
이름: 2-(4-amino-2-methoxyphenyl)benzothiazole
SMILES: COc1cc(N)ccc1-c1nc2ccccc2s1

Molecular Processing

Molecular formula
C14H12N2OS
Molecular weight
256.33
Exact mass
256.067
XLogP
3.55
TPSA
48.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
76.02

Supplementary Information

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