C1=C(C(=C2C(=C1Cl)N=C(S2)Cl)N)F
名称: 2,4-dichloro-6-fluoro-1,3-benzothiazol-7-amine
SMILES: C1=C(C(=C2C(=C1Cl)N=C(S2)Cl)N)F

Molecular Processing

Molecular formula
C7H3Cl2FN2S
Molecular weight
237.09
Exact mass
235.9378
XLogP
3.32
TPSA
38.91
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
54.01

Supplementary Information

InChIKey: IWMKNZUMMDXISN-UHFFFAOYSA-N
同義語
SCHEMBL9148367IWMKNZUMMDXISN-UHFFFAOYSA-N7-amino-2,4-dichloro-6-fluorobenzothiazole7-amino-2,4-dichloro-6-fluoro-benzothiazole
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