5-Chloro-2-mercaptobenzothiazole
5-chloro-3H-1,3-benzothiazole-2-thione
Molecular Identity
5-Chloro-2-mercaptobenzothiazole
5-chloro-3H-1,3-benzothiazole-2-thione
PubChem CID: 2723842
2D Structure
Properties
C7H4ClNS2
Molecular Formula
201.70
Molecular Weight
g/mol
200.9474
Exact Mass
Da
3
XLogP
Drug-like (Lipinski: < 5)
69.4
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
2
H-Bond Acceptors
185
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
5-Chloro-2-mercaptobenzothiazole5331-91-9SH-Benzothiazole2(3H)-Benzothiazolethione, 5-chloro-5-Chloro-2-benzothiazolethiol2-BENZOTHIAZOLETHIOL, 5-CHLORO-NSC-3934R9099U429RRefChem:534567226-235-05-Chlorobenzo[d]thiazole-2(3H)-thione5-chloro-1,3-benzothiazole-2-thiol5-chloro-3H-1,3-benzothiazole-2-thione5-Chlorobenzo[d]thiazole-2-thiol5-chlorobenzothiazole-2-thiol
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 5-Chloro-2-mercaptobenzothiazole
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