Basic information
- Standard SMILES
COC(=O)CCNC(C(=O)N1CC(c2cc(F)ccc2F)=CC1c1ccccc1)C1CC1- InChIKey
NODHZQBCUPGXJH-UHFFFAOYSA-N- Molecular formula
- C25H26F2N2O3
- Average molar mass
- 440.5 g/mol
- Monoisotopic mass
- 440.19114902
Names & identifiers
- IUPAC
- methyl 3-[[1-cyclopropyl-2-[4-(2,5-difluorophenyl)-2-phenyl-2,5-dihydropyrrol-1-yl]-2-oxoethyl]amino]propanoate
Database identifiers
- PubChem CID
- 72378257
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 705
Related reactions
2 records
Compound notes
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