Basic information
- Standard SMILES
COC(CN(C(=O)Nc1ccc(OCc2ccccc2)cc1)c1ccc(Oc2ccccc2)cc1)OC- InChIKey
RUTMTWOUCLFSTH-UHFFFAOYSA-N- Molecular formula
- C30H30N2O5
- Average molar mass
- 498.6 g/mol
- Monoisotopic mass
- 498.21547206
Names & identifiers
- Preferred name
- 3-(4-Benzyloxyphenyl)-1-(2,2-dimethoxyethyl)-1-(4-phenoxyphenyl)urea
- IUPAC
- 1-(2,2-dimethoxyethyl)-1-(4-phenoxyphenyl)-3-(4-phenylmethoxyphenyl)urea
Names & synonyms
SCHEMBL6080821RUTMTWOUCLFSTH-UHFFFAOYSA-N3-(4-benzyloxyphenyl)-1-(2,2-dimethoxyethyl)-1-(4-phenoxy-phenyl)urea3-(4-Benzyloxyphenyl)-1-(2,2-dimethoxyethyl)-1-(4-phenoxyphenyl)urea
Database identifiers
- PubChem CID
- 21873322
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 69.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 632
Related reactions
3 records
Compound notes
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