C1=CC(=C2C(=C1)SC(=N2)N)N
CAS: 861100-75-6
Название: 1,3-benzothiazole-2,4-diamine
SMILES: C1=CC(=C2C(=C1)SC(=N2)N)N

Molecular Processing

Molecular formula
C7H7N3S
Molecular weight
165.22
Exact mass
165.0361
XLogP
1.46
TPSA
64.93
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
48.44

Supplementary Information

InChIKey: JHRMJWGBGBDNJE-UHFFFAOYSA-N
Синонимы
Benzo[d]thiazole-2,4-diamine1,3-BENZOTHIAZOLE-2,4-DIAMINE861100-75-6benzothiazole-2,4-diamineMFCD09972079Diaminobenzthiazolebisaminobenzothiazolebenzothiazole diamineSCHEMBL969167JHRMJWGBGBDNJE-UHFFFAOYSA-NAKOS000299455DA-02134SY398662G74808
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