Basic information
- Standard SMILES
CCOC(=O)C1(c2ccc(-c3ccc(-c4onc(C)c4CC(O)CN(Cc4ccccc4)C(C)=O)cc3)cc2)CC1- InChIKey
MZEICHZTJHTUFN-UHFFFAOYSA-N- Molecular formula
- C34H36N2O5
- Average molar mass
- 552.7 g/mol
Names & identifiers
- Preferred name
- 1-(4'-{4-[3-(Acetyl-benzyl-amino)-2-hydroxy-propyl]-3-methyl-isoxazol-5-yl}-biphenyl-4-yl)-cyclopropanecarboxylic acid ethyl ester
- IUPAC
- ethyl 1-[4-[4-[4-[3-[acetyl(benzyl)amino]-2-hydroxypropyl]-3-methyl-1,2-oxazol-5-yl]phenyl]phenyl]cyclopropane-1-carboxylate
Names & synonyms
SCHEMBL12210MZEICHZTJHTUFN-UHFFFAOYSA-N1-(4'-{4-[3-(Acetyl-benzyl-amino)-2-hydroxy-propyl]-3-methyl-isoxazol-5-yl}-biphenyl-4-yl)-cyclopropanecarboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 66580452
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 92.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 855
Related reactions
1 records
Compound notes
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