Basic information
- Standard SMILES
O=C(NC(CCNCCc1ccccn1)c1ccccc1)C1SCCN1S(=O)(=O)c1ccc(-c2ccccc2)cc1- InChIKey
XYTHQBWYNYKWAB-UHFFFAOYSA-N- Molecular formula
- C32H34N4O3S2
- Average molar mass
- 586.8 g/mol
Names & identifiers
- Preferred name
- 3-([1,1'-biphenyl]-4-ylsulfonyl)-N-(1-phenyl-3-{[2-(2-pyridinyl)ethyl]-amino}propyl)-1,3-thiazolidine-2-carboxamide
- IUPAC
- 3-(4-phenylphenyl)sulfonyl-N-[1-phenyl-3-(2-pyridin-2-ylethylamino)propyl]-1,3-thiazolidine-2-carboxamide
Names & synonyms
SCHEMBL3380111XYTHQBWYNYKWAB-UHFFFAOYSA-N3-([1,1'-biphenyl]-4-ylsulfonyl)-N-(1-phenyl-3-{[2-(2-pyridinyl)ethyl]-amino}propyl)-1,3-thiazolidine-2-carboxamide3-([1,1'-biphenyl]-4-ylsulfonyl)-N-(1-phenyl-3-{[2-(2-pyridinyl)ethyl]amino}propyl)-1,3-thiazolidine-2-carboxamide
Database identifiers
- PubChem CID
- 60036760
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 893
Related reactions
2 records
Compound notes
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