Basic information
- Standard SMILES
COC(=O)C1CCN(c2nc(-c3ccccc3)cs2)C1- InChIKey
AVLUTUOKGSRPHW-UHFFFAOYSA-N- Molecular formula
- C15H16N2O2S
- Average molar mass
- 288.4 g/mol
Names & identifiers
- Preferred name
- Methyl 1-(4-phenylthiazol-2-yl)pyrrolidine-3-carboxylate
- IUPAC
- methyl 1-(4-phenyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxylate
Names & synonyms
SCHEMBL2224594AVLUTUOKGSRPHW-UHFFFAOYSA-Nmethyl 1-(4-phenylthiazol-2-yl)pyrrolidine-3-carboxylate
Database identifiers
- PubChem CID
- 67323747
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
Related reactions
2 records
Compound notes
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