4-(2-((1S,2S)-2-hydroxycyclohexylamino)benzo[d]thiazol-6-yloxy)-N-methylpicolinamide

HCID 57725464

Basic information

Standard SMILES
CNC(=O)c1cc(Oc2ccc3nc(N[C@H]4CCCC[C@@H]4O)sc3c2)ccn1
InChIKey
ADZBMFGQQWPHMJ-YOEHRIQHSA-N
Molecular formula
C20H22N4O3S
Average molar mass
398.5 g/mol
Monoisotopic mass
398.14126175

Names & identifiers

Preferred name
4-(2-((1S,2S)-2-hydroxycyclohexylamino)benzo[d]thiazol-6-yloxy)-N-methylpicolinamide
IUPAC
4-[[2-[[(1S,2S)-2-hydroxycyclohexyl]amino]-1,3-benzothiazol-6-yl]oxy]-N-methylpyridine-2-carboxamide

Names & synonyms

orb3172939SCHEMBL2676088CHEMBL4065459ADZBMFGQQWPHMJ-YOEHRIQHSA-N4-(2-((1S,2S)-2-hydroxycyclohexylamino)benzo[d]thiazol-6-yloxy)-N-methylpicolinamide953769-26-1

Database identifiers

PubChem CID
57725464
ChEMBL
CHEMBL4065459

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
125 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
28

Related reactions

3 records

Compound notes

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