Basic information
- Standard SMILES
COc1ccc(COC(c2ccccc2)(c2ccc(OC)cc2)C2CC(O)CN2C(=O)CCCCCNC(=O)OCc2ccccc2)cc1- InChIKey
VVEUFFGEMTZOQM-UHFFFAOYSA-N- Molecular formula
- C40H46N2O7
- Average molar mass
- 666.8 g/mol
- Monoisotopic mass
- 666.33050181
Names & identifiers
- Preferred name
- benzyl N-[6-[4-hydroxy-2-[(4-methoxyphenyl)-[(4-methoxyphenyl)methoxy]-phenylmethyl]pyrrolidin-1-yl]-6-oxohexyl]carbamate
- IUPAC
- benzyl N-[6-[4-hydroxy-2-[(4-methoxyphenyl)-[(4-methoxyphenyl)methoxy]-phenylmethyl]pyrrolidin-1-yl]-6-oxohexyl]carbamate
Names & synonyms
SCHEMBL3422392
Database identifiers
- PubChem CID
- 68636491
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 17
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 970
Related reactions
1 records
Compound notes
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