Basic information
- Standard SMILES
CN(Cc1cccc(-c2ccc(CC3SC(=O)NC3=O)cc2)c1)C(=O)c1ccno1- InChIKey
XGDJRSVJBAYZIZ-UHFFFAOYSA-N- Molecular formula
- C22H19N3O4S
- Average molar mass
- 421.5 g/mol
Names & identifiers
- Preferred name
- N-[4'-(2,4-Dioxothiazolidin-5-ylmethyl)biphenyl-3-ylmethyl]-N-methylisoxazole-5-carboxamide
- IUPAC
- N-[[3-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenyl]phenyl]methyl]-N-methyl-1,2-oxazole-5-carboxamide
Names & synonyms
SCHEMBL6184880XGDJRSVJBAYZIZ-UHFFFAOYSA-NN-[4'-(2,4-Dioxothiazolidin-5-ylmethyl)biphenyl-3-ylmethyl]-N-methylisoxazole-5-carboxamide
Database identifiers
- PubChem CID
- 10112911
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 118 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 652
Related reactions
2 records
Compound notes
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