Basic information
- Standard SMILES
COc1ccc2cc(C(C)C(=O)OC(Cc3c(Cl)cncc3Cl)c3ccc(OC(F)F)c(OCC4CC4)c3)ccc2c1- InChIKey
GEDIRLHJIPUIGJ-UHFFFAOYSA-N- Molecular formula
- C32H29Cl2F2NO5
- Average molar mass
- 616.5 g/mol
- Monoisotopic mass
- 615.1390847
Names & identifiers
- Preferred name
- (+)-2-(6-Methoxy-naphthalen-2-yl)-propionic acid 1-(3-cyclopropyl methoxy-4-difluoromethoxy-phenyl)-2-(3,5-dichloro-pyridin-4-yl)-ethyl ester
- IUPAC
- [1-[3-(cyclopropylmethoxy)-4-(difluoromethoxy)phenyl]-2-(3,5-dichloro-4-pyridinyl)ethyl] 2-(6-methoxynaphthalen-2-yl)propanoate
Names & synonyms
(+)-2-(6-Methoxy-naphthalen-2-yl)-propionic acid 1-(3-cyclopropyl methoxy-4-difluoromethoxy-phenyl)-2-(3,5-dichloro-pyridin-4-yl)-ethyl esterSCHEMBL26798112-(6-Methoxy-naphthalen-2-yl)-propionic acid 1-(3-cyclopropylmethoxy-4-difluoromethoxy-phenyl)-2-(3,5-dichloro-pyridin-4-yl)-ethyl ester
Database identifiers
- PubChem CID
- 67494397
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 859
Related reactions
4 records
Compound notes
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