Basic information
- Standard SMILES
COc1ccc(N(Cc2ccc(C)cc2)Cc2ccc(C)cc2)cc1NC(=S)NC(=O)c1ccccc1- InChIKey
FCBJIWWYHLSWOT-UHFFFAOYSA-N- Molecular formula
- C31H31N3O2S
- Average molar mass
- 509.7 g/mol
Names & identifiers
- Preferred name
- 1-Benzoyl-3-{5-[bis-(4-methyl-benzyl)-amino]-2-methoxy-phenyl}-thiourea
- IUPAC
- N-[[5-[bis[(4-methylphenyl)methyl]amino]-2-methoxyphenyl]carbamothioyl]benzamide
Names & synonyms
SCHEMBL5713596FCBJIWWYHLSWOT-UHFFFAOYSA-N1-benzoyl-3-{5-[bis-(4-methyl-benzyl)-amino]-2-methoxy-phenyl}-thiourea
Database identifiers
- PubChem CID
- 22015738
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 85.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 687
Related reactions
4 records
Compound notes
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