C1=CC2=C(C=C1N)N=C(S2)N
CAS: 50480-29-0
Название: 1,3-benzothiazole-2,5-diamine
SMILES: C1=CC2=C(C=C1N)N=C(S2)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: HGSZQBRMZNHXJZ-UHFFFAOYSA-N
Синонимы
1,3-benzothiazole-2,5-diamine50480-29-0Benzo[d]thiazole-2,5-diamineBenzothiazole-2,5-diamineMFCD007818382,5-Benzothiazolediamine(9CI)2,5-benzothiazolediamineUPENN_ABS_032MLS0022804905-amino-benzothiazol-2-ylamineSCHEMBL2190447CHEMBL1719861AMH_003DTXSID00354313HGSZQBRMZNHXJZ-UHFFFAOYSA-NHMS2204K23STK500889AKOS000108124AT27607SMR001318310SY398661TS-00129DB-031036CS-0370425EN300-2982972F029998
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