Ethyl (5-chloro-4-(5-fluoro-2-benzothiazolyl)amino-2-fluorophenyl)acetate

HCID 58778765
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Basic information

Standard SMILES
CCOC(=O)Cc1cc(Cl)c(Nc2nc3cc(F)ccc3s2)cc1F
InChIKey
KOOQDLXDDFGUGX-UHFFFAOYSA-N
Molecular formula
C17H13ClF2N2O2S
Average molar mass
382.8 g/mol

Names & identifiers

Preferred name
Ethyl (5-chloro-4-(5-fluoro-2-benzothiazolyl)amino-2-fluorophenyl)acetate
IUPAC
ethyl 2-[5-chloro-2-fluoro-4-[(5-fluoro-1,3-benzothiazol-2-yl)amino]phenyl]acetate

Names & synonyms

SCHEMBL14371937KOOQDLXDDFGUGX-UHFFFAOYSA-Nethyl (5-chloro-4-(5-fluoro-2-benzothiazolyl)amino-2-fluorophenyl)acetate

Database identifiers

PubChem CID
58778765

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
79.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
25

Related reactions

4 records
New reaction record

Linked notes

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