Basic information
- Standard SMILES
COc1ccc2nc(-c3ccc(NC(=O)c4ccc(OC(C)=O)cc4)cc3)sc2c1- InChIKey
VCDSWDOGIXWVIL-UHFFFAOYSA-N- Molecular formula
- C23H18N2O4S
- Average molar mass
- 418.5 g/mol
- Monoisotopic mass
- 418.09872823
Names & identifiers
- Preferred name
- 4-Acetoxy-N-[4-(6-methoxybenzothiazol-2-yl)-phenyl]-benzamide
- IUPAC
- [4-[[4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]carbamoyl]phenyl] acetate
Names & synonyms
SCHEMBL2193573VCDSWDOGIXWVIL-UHFFFAOYSA-N4-Acetoxy-N-[4-(6-methoxybenzothiazol-2-yl)-phenyl]-benzamide
Database identifiers
- PubChem CID
- 67312482
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 602
Related reactions
1 records
Compound notes
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