N,N-Dibenzyl-N'-(2,4,5-trimethylphenyl)urea
Basic information
- CAS
86764-36-5- Standard SMILES
Cc1cc(C)c(NC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1C- InChIKey
CRIIESGQQIOAON-UHFFFAOYSA-N- Molecular formula
- C24H26N2O
- Average molar mass
- 358.5 g/mol
- Monoisotopic mass
- 358.20451346
Names & identifiers
- Preferred name
- N,N-Dibenzyl-N'-(2,4,5-trimethylphenyl)urea
- IUPAC
- 1,1-dibenzyl-3-(2,4,5-trimethylphenyl)urea
Names & synonyms
CHEMBL7522486764-36-5N,N-Dibenzyl-N'-(2,4,5-trimethylphenyl)ureaDTXSID60608162BDBM50227918
Database identifiers
- CAS
86764-36-5- PubChem CID
- 20499485
- DTXSID
DTXSID60608162- ChEMBL
CHEMBL75224
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 433
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Compound notes
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