Basic information
- CAS
99616-21-4- Standard SMILES
COc1cc(C(=O)Nc2ccc(C(=O)NN3C(=O)CSC3=Nc3ccc(Cl)cc3)cc2)cc(OC)c1OC- InChIKey
YFCQBYIFSXIVFK-UHFFFAOYSA-N- Molecular formula
- C26H23ClN4O6S
- Average molar mass
- 555 g/mol
- Monoisotopic mass
- 554.1026833
Names & identifiers
- Preferred name
- Benzamide, N-(4-(((2-((4-chlorophenyl)imino)-4-oxo-3-thiazolidinyl)amino)carbonyl)phenyl)-3,4,5-trimethoxy-
- IUPAC
- N-[4-[[2-(4-chlorophenyl)imino-4-oxo-1,3-thiazolidin-3-yl]carbamoyl]phenyl]-3,4,5-trimethoxybenzamide
Names & synonyms
99616-21-4N-[4-[[2-(4-chlorophenyl)imino-4-oxo-1,3-thiazolidin-3-yl]carbamoyl]phenyl]-3,4,5-trimethoxybenzamideBenzamide, N-(4-(((2-((4-chlorophenyl)imino)-4-oxo-3-thiazolidinyl)amino)carbonyl)phenyl)-3,4,5-trimethoxy-DTXSID401384663
Database identifiers
- CAS
99616-21-4- PubChem CID
- 57516
- DTXSID
DTXSID401384663
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 864
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…