Basic information
- Standard SMILES
CCOC(=O)Cc1cn(Cc2ccc(OCc3nc(-c4ccccc4)sc3C)nc2)nc1-c1ccccc1- InChIKey
SGPUYAFVHQBRSK-UHFFFAOYSA-N- Molecular formula
- C30H28N4O3S
- Average molar mass
- 524.6 g/mol
Names & identifiers
- Preferred name
- ethyl [1-[6-(5-methyl-2-phenyl-4-thiazolylmethoxy)-3-pyridylmethyl]-3-phenyl-1H-pyrazol-4-yl]acetate
- IUPAC
- ethyl 2-[1-[[6-[(5-methyl-2-phenyl-1,3-thiazol-4-yl)methoxy]-3-pyridinyl]methyl]-3-phenylpyrazol-4-yl]acetate
Names & synonyms
SGPUYAFVHQBRSK-UHFFFAOYSA-Nethyl [1-[6-(5-methyl-2-phenyl-4-thiazolylmethoxy)-3-pyridylmethyl]-3-phenyl-1H-pyrazol-4-yl]acetate
Database identifiers
- PubChem CID
- 86760434
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 732
Related reactions
3 records
Compound notes
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