4-(2-Benzothiazolyl)-2-chloro-benzenamine

HCID 387950

Basic information

Standard SMILES
Nc1ccc(-c2nc3ccccc3s2)cc1Cl
InChIKey
VMHNOJKXMWYAGM-UHFFFAOYSA-N
Molecular formula
C13H9ClN2S
Average molar mass
260.74 g/mol

Names & identifiers

Preferred name
4-(2-Benzothiazolyl)-2-chloro-benzenamine
IUPAC
4-(1,3-benzothiazol-2-yl)-2-chloroaniline

Names & synonyms

4-(2-Benzothiazolyl)-2-chloro-benzenamine178804-10-94-(1,3-benzothiazol-2-yl)-2-chloroaniline4-(Benzo[d]thiazol-2-yl)-2-chloroanilineMFCD00950807NSC682303NSC-6823032-(4'-amino-3'-chlorophenyl)benzothiazoleCHEMBL12231SCHEMBL6284593VMHNOJKXMWYAGM-UHFFFAOYSA-NAKOS005133979
Show more names
2-(4-amino-3-chlorophenyl)benzothiazole4-benzothiazol-2-yl-2-chlorophenylamineNCI60_029438[4-(benzothiazolyl)-2-chloro-phenyl]-amine2-(4'-amino-3'-chlorophenyl) benzothiazoleCS-03367724-(1,3-benzothiazol-2-yl)-2-chloro-anilineBenzenamine, 2-chloro-4-(benzothiazol-2-yl)-

Database identifiers

PubChem CID
387950
ChEMBL
CHEMBL12231
Nikkaji
J748.055E

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
67.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
17

Related reactions

3 records

Compound notes

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