Basic information
- Standard SMILES
C#CCOc1cccc(C(CC)(OC)c2nccs2)c1- InChIKey
SBLHWTXSJQDMFW-UHFFFAOYSA-N- Molecular formula
- C16H17NO2S
- Average molar mass
- 287.4 g/mol
Names & identifiers
- Preferred name
- 2-[1-(3-(2-Propynyloxy)phenyl)-1-methoxypropyl]thiazole
- IUPAC
- 2-[1-methoxy-1-(3-prop-2-ynoxyphenyl)propyl]-1,3-thiazole
Names & synonyms
SCHEMBL9372791SBLHWTXSJQDMFW-UHFFFAOYSA-N2-[1-(3-(2-propynyloxy)phenyl)-1-methoxypropyl]thiazole
Database identifiers
- PubChem CID
- 15049974
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Related reactions
3 records
Compound notes
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