(R)-4-[5-(4-Methanesulfonyl-phenyl)-2-methyl-2,3-dihydro-furo[2,3-c]pyridin-2-yl]-piperidine-1-carboxylic acid tert-butyl ester
Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC([C@@]2(C)Cc3cc(-c4ccc(S(C)(=O)=O)cc4)ncc3O2)CC1- InChIKey
NBTYPNGITJWZLJ-RUZDIDTESA-N- Molecular formula
- C25H32N2O5S
- Average molar mass
- 472.6 g/mol
Names & identifiers
- Preferred name
- (R)-4-[5-(4-Methanesulfonyl-phenyl)-2-methyl-2,3-dihydro-furo[2,3-c]pyridin-2-yl]-piperidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl 4-[(2R)-2-methyl-5-(4-methylsulfonylphenyl)-3H-furo[2,3-c]pyridin-2-yl]piperidine-1-carboxylate
Names & synonyms
SCHEMBL14244872NBTYPNGITJWZLJ-RUZDIDTESA-N(R)-4-[5-(4-Methanesulfonyl-phenyl)-2-methyl-2,3-dihydro-furo[2,3-c]pyridin-2-yl]-piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 71115212
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 94.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 804
Related reactions
2 records
Compound notes
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