N-(3-Chlorophenyl)-N'-((4-methoxyphenyl)methyl)urea
Basic information
- CAS
379701-45-8- Standard SMILES
COc1ccc(CNC(=O)Nc2cccc(Cl)c2)cc1- InChIKey
SWYHVSWQJBGHCA-UHFFFAOYSA-N- Molecular formula
- C15H15ClN2O2
- Average molar mass
- 290.74 g/mol
- Monoisotopic mass
- 290.0822054
Names & identifiers
- Preferred name
- N-(3-Chlorophenyl)-N'-((4-methoxyphenyl)methyl)urea
- IUPAC
- 1-(3-chlorophenyl)-3-[(4-methoxyphenyl)methyl]urea
Names & synonyms
379701-45-8N-(3-Chlorophenyl)-N'-[(4-methoxyphenyl)methyl]ureaN-(3-Chlorophenyl)-N'-((4-methoxyphenyl)methyl)ureaRefChem:3613251-(3-chlorophenyl)-3-(4-methoxybenzyl)ureaMLS0012302711-(3-chlorophenyl)-3-[(4-methoxyphenyl)methyl]ureaCHEMBL1347251DTXSID201224817HMS2972G24STK401615AKOS001016564
Show more names
SMR000678080ST50935014N-(3-chlorophenyl)-N'-(4-methoxybenzyl)ureaZ44603449N-(3-Chlorophenyl)-Na(2)-[(4-methoxyphenyl)methyl]ureaN-(3-chlorophenyl){[(4-methoxyphenyl)methyl]amino}carboxamide
Database identifiers
- CAS
379701-45-8- PubChem CID
- 894484
- DTXSID
DTXSID201224817- ChEMBL
CHEMBL1347251
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 306
Experimental & physicochemical properties
Solubility1.1 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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