Basic information
- Standard SMILES
COC(=O)C1CC(SC(c2ccccc2)(c2ccccc2)c2ccccc2)CN1S(=O)(=O)c1ccc2ccccc2c1- InChIKey
GCCNSVUHDCJNIX-UHFFFAOYSA-N- Molecular formula
- C35H31NO4S2
- Average molar mass
- 593.8 g/mol
Names & identifiers
- Preferred name
- Methyl 1-naphthalen-2-ylsulfonyl-4-tritylsulfanylpyrrolidine-2-carboxylate
- IUPAC
- methyl 1-naphthalen-2-ylsulfonyl-4-tritylsulfanylpyrrolidine-2-carboxylate
Names & synonyms
SCHEMBL6968348
Database identifiers
- PubChem CID
- 69948491
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 947
Related reactions
1 records
Compound notes
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