Ethyl 2-(7-(4-(Pyrrolidin-1-yl)-3-(trifluoromethyl)benzyloxy)-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetate
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Basic information
- Standard SMILES
CCOC(=O)CC1CCc2c1[nH]c1ccc(OCc3ccc(N4CCCC4)c(C(F)(F)F)c3)cc21- InChIKey
OQBKNIPFLLKTDU-UHFFFAOYSA-N- Molecular formula
- C27H29F3N2O3
- Average molar mass
- 486.5 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(7-(4-(Pyrrolidin-1-yl)-3-(trifluoromethyl)benzyloxy)-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetate
- IUPAC
- ethyl 2-[7-[[4-pyrrolidin-1-yl-3-(trifluoromethyl)phenyl]methoxy]-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl]acetate
Names & synonyms
Ethyl 2-(7-(4-(Pyrrolidin-1-yl)-3-(trifluoromethyl)benzyloxy)-1,2,3,4-tetrahydrocyclopenta[b]indol-3-yl)acetateSCHEMBL1942213
Database identifiers
- PubChem CID
- 67220173
Properties
Computed structural propertiesFilling in
- XLogP
- 5.7
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 729
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Related reactions
6 records
Compound notes
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