Basic information
- Standard SMILES
CC(=O)Nc1ccc(C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)cc1- InChIKey
MEYASCISSHWIMK-UHFFFAOYSA-N- Molecular formula
- C23H19N5O3S
- Average molar mass
- 445.5 g/mol
- Monoisotopic mass
- 445.12086066
Names & identifiers
- Preferred name
- 5-(4-Acetamidobenzamido)-2-(naphthalen-2-ylamino)thiazole-4-carboxamide
- IUPAC
- 5-[(4-acetamidobenzoyl)amino]-2-(naphthalen-2-ylamino)-1,3-thiazole-4-carboxamide
Names & synonyms
CHEMBL3683983SCHEMBL15559640MEYASCISSHWIMK-UHFFFAOYSA-NBDBM173967US9102637, 25-(4-acetamidobenzamido)-2-(naphthalen-2-ylamino)thiazole-4-carboxamide
Database identifiers
- PubChem CID
- 72550190
- ChEMBL
CHEMBL3683983
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 154 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 699
Related reactions
1 records
Compound notes
Loading…