Basic information
- CAS
89011-22-3- Standard SMILES
S=C(N=C(Nc1ccccc1)Nc1ccccc1)NCc1ccccc1- InChIKey
KNVGTNPTOPLNDZ-UHFFFAOYSA-N- Molecular formula
- C21H20N4S
- Average molar mass
- 360.5 g/mol
- Monoisotopic mass
- 360.14086783
Names & identifiers
- Preferred name
- N-Benzyl-N'-(dianilinomethylidene)thiourea
- IUPAC
- 1-benzyl-3-(dianilinomethylidene)thiourea
Names & synonyms
89011-22-3N-Benzyl-N'-(dianilinomethylidene)thioureaDTXSID40526658
Database identifiers
- CAS
89011-22-3- PubChem CID
- 13198130
- DTXSID
DTXSID40526658
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 425
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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