Basic information
- Standard SMILES
CCO[C@@H](Cc1ccc(OCc2nc(-c3ccccc3OC)oc2C)cc1Cl)C(=O)OC- InChIKey
VDYHOFRRFFOTJP-QFIPXVFZSA-N- Molecular formula
- C24H26ClNO6
- Average molar mass
- 459.9 g/mol
- Monoisotopic mass
- 459.1448652
Names & identifiers
- Preferred name
- (S)-3-{2-chloro-4-[2-(2-methoxy-phenyl)-5-methyl-oxazol-4-ylmethoxy]-phenyl]-2-ethoxy-propionic acid methyl ester
- IUPAC
- methyl (2S)-3-[2-chloro-4-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]phenyl]-2-ethoxypropanoate
Names & synonyms
(S)-3-{2-chloro-4-[2-(2-methoxy-phenyl)-5-methyl-oxazol-4-ylmethoxy]-phenyl]-2-ethoxy-propionic acid methyl ester(S)-3-{2-chloro-4-[2-(2-methoxy-phenyl)-5-methyl-oxazol-4-ylmethoxy]-phenyl}-2-ethoxy-propionic acid methyl esterSCHEMBL5018060VDYHOFRRFFOTJP-QFIPXVFZSA-N
Database identifiers
- PubChem CID
- 69280736
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 581
Related reactions
4 records
Compound notes
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