(2S)-1-(2-methylbenzothiazol-5-yloxy)butan-2-ol

HCID 69622255
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Basic information

Standard SMILES
CC[C@H](O)COc1ccc2sc(C)nc2c1
InChIKey
HOUIDRMAUWOPLD-VIFPVBQESA-N
Molecular formula
C12H15NO2S
Average molar mass
237.32 g/mol

Names & identifiers

Preferred name
(2S)-1-(2-methylbenzothiazol-5-yloxy)butan-2-ol
IUPAC
(2S)-1-[(2-methyl-1,3-benzothiazol-5-yl)oxy]butan-2-ol

Names & synonyms

SCHEMBL5965179HOUIDRMAUWOPLD-VIFPVBQESA-N(2S)-1-(2-methylbenzothiazol-5-yloxy)butan-2-ol

Database identifiers

PubChem CID
69622255

Properties

Computed structural properties

XLogP
3
Topological polar surface area
70.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
16

Related reactions

2 records
New reaction record

Compound notes

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