2-bromo-N-(4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-isonicotinamide

HCID 22993429
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Basic information

Standard SMILES
COc1ccc(N2CCOCC2)c2sc(NC(=O)c3ccnc(Br)c3)nc12
InChIKey
UGMKRCSTZYMGIN-UHFFFAOYSA-N
Molecular formula
C18H17BrN4O3S
Average molar mass
449.3 g/mol

Names & identifiers

Preferred name
2-bromo-N-(4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-isonicotinamide
IUPAC
2-bromo-N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide

Names & synonyms

SCHEMBL5566040UGMKRCSTZYMGIN-UHFFFAOYSA-N2-bromo-N-(4-methoxy-7-mopholin-4-yl-benzothiazol-2-yl)-isonicotinamide2-bromo-N-(4-methoxy-7-morpholin-4-yl-benzothiazol-2-y)-isonicotinamide2-bromo-N-(4-methoxy-7-morpholin-4-yl-benzothiazol-2-yl)-isonicotinamide

Database identifiers

PubChem CID
22993429

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
105 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
27

Related reactions

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Compound notes

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