2-((4-Oxo-8-(3-(2'-oxospiro[cyclopropane-1,3'-indoline]-1'-yl)propyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl)methyl)benzoic acid
Basic information
- Standard SMILES
O=C(O)c1ccccc1CN1CN(c2ccccc2)C2(CCN(CCCN3C(=O)C4(CC4)c4ccccc43)CC2)C1=O- InChIKey
ONEYTTSXTDQUCA-UHFFFAOYSA-N- Molecular formula
- C34H36N4O4
- Average molar mass
- 564.7 g/mol
Names & identifiers
- Preferred name
- 2-((4-Oxo-8-(3-(2'-oxospiro[cyclopropane-1,3'-indoline]-1'-yl)propyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl)methyl)benzoic acid
- IUPAC
- 2-[[4-oxo-8-[3-(2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl)propyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl]methyl]benzoic acid
Names & synonyms
SCHEMBL318247ONEYTTSXTDQUCA-UHFFFAOYSA-N2-((4-Oxo-8-(3-(2'-oxospiro[cyclopropane-1,3'-indoline]-1'-yl)propyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-3-yl)methyl)benzoic acid
Database identifiers
- PubChem CID
- 54771983
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 84.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 1,030
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Related reactions
1 records
Compound notes
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