Basic information
- Standard SMILES
O=C(Nc1ccc(NC(=S)Nc2ccccc2)cc1)c1ccc(NC(=S)Nc2ccccc2)cc1- InChIKey
HQPBUMDSBJZECV-UHFFFAOYSA-N- Molecular formula
- C27H23N5OS2
- Average molar mass
- 497.6 g/mol
Names & identifiers
- Preferred name
- 4,4'-Di(phenylthiocarbamoylamino)benzanilide
- IUPAC
- 4-(phenylcarbamothioylamino)-N-[4-(phenylcarbamothioylamino)phenyl]benzamide
Names & synonyms
SCHEMBL8612020HQPBUMDSBJZECV-UHFFFAOYSA-N4,4'-di(phenylthiocarbamoylamino)benzanilide
Database identifiers
- PubChem CID
- 19693281
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 692
Related reactions
1 records
Linked notes
Loading…