Basic information
- Standard SMILES
O=C(O)CCc1cn(Cc2ccc3cc(OCc4cccnc4)ccc3c2)cc1-c1ccccc1- InChIKey
KLLZUVFUZCVCRL-UHFFFAOYSA-N- Molecular formula
- C30H26N2O3
- Average molar mass
- 462.5 g/mol
Names & identifiers
- Preferred name
- 3-[4-Phenyl-1-[6-(3-pyridylmethoxy)-2-naphthylmethyl]-3-pyrrolyl]propionic acid
- IUPAC
- 3-[4-phenyl-1-[[6-(pyridin-3-ylmethoxy)naphthalen-2-yl]methyl]pyrrol-3-yl]propanoic acid
Names & synonyms
SCHEMBL5385317KLLZUVFUZCVCRL-UHFFFAOYSA-N3-[4-phenyl-1-[6-(3-pyridylmethoxy)-2-naphthylmethyl]-3-pyrrolyl]propionic acid
Database identifiers
- PubChem CID
- 69423919
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 666
Related reactions
2 records
Compound notes
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