Basic information
- Standard SMILES
CCCN(CCC)C(=O)c1cc(C(=O)OC)cc(-c2ccc(S(=O)(=O)N(C)C)cc2)c1- InChIKey
SYSQWRUYQDSQNM-UHFFFAOYSA-N- Molecular formula
- C23H30N2O5S
- Average molar mass
- 446.6 g/mol
Names & identifiers
- Preferred name
- Methyl 4'-[(dimethylamino)sulfonyl]-5-[(dipropylamino)carbonyl)[1,1'-biphenyl]-3-carboxylate
- IUPAC
- methyl 3-[4-(dimethylsulfamoyl)phenyl]-5-(dipropylcarbamoyl)benzoate
Names & synonyms
methyl 4'-[(dimethylamino)sulfonyl]-5-[(dipropylamino)carbonyl)[1,1'-biphenyl]-3-carboxylatemethyl 4'-[(dimethylamino)sulfonyl]-5-[(dipropylamino)carbonyl][1,1'-biphenyl]-3-carboxylateSCHEMBL6139649SYSQWRUYQDSQNM-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 69680482
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 689
Related reactions
7 records
Compound notes
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