Basic information
- Standard SMILES
COc1ccc(C2COCCO2)c2sc(N)nc12- InChIKey
OZOPULCQLDYYIP-UHFFFAOYSA-N- Molecular formula
- C12H14N2O3S
- Average molar mass
- 266.32 g/mol
Names & identifiers
- Preferred name
- (+)-7-[1,4)Dioxan-2-yl-4-methoxy-benzothiazol-2-ylamine
- IUPAC
- 7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-amine
Names & synonyms
(+)-7-[1,4)dioxan-2-yl-4-methoxy-benzothiazol-2-ylamine(+)-7-[1,4]dioxan-2-yl-4-methoxy-benzothiazol-2-ylamineSCHEMBL5561864OZOPULCQLDYYIP-UHFFFAOYSA-N(+/-)-7-[1,4]dioxan-2-yl-4-methoxy-benzothiazol-2-ylamine
Database identifiers
- PubChem CID
- 22507697
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 94.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 294
Related reactions
103 records
Compound notes
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