N-(4-methoxybenzyl)[1,1'-biphenyl]-4-carboxamide
Basic information
- CAS
287945-52-2- Standard SMILES
COc1ccc(CNC(=O)c2ccc(-c3ccccc3)cc2)cc1- InChIKey
WEAABOAXWGOJPX-UHFFFAOYSA-N- Molecular formula
- C21H19NO2
- Average molar mass
- 317.4 g/mol
- Monoisotopic mass
- 317.14157885
Names & identifiers
- Preferred name
- N-(4-methoxybenzyl)[1,1'-biphenyl]-4-carboxamide
- IUPAC
- N-[(4-methoxyphenyl)methyl]-4-phenylbenzamide
Names & synonyms
N-(4-methoxybenzyl)[1,1'-biphenyl]-4-carboxamideN-[(4-Methoxyphenyl)methyl][1,1'-biphenyl]-4-carboxamideN-(4-methoxybenzyl)biphenyl-4-carboxamideOprea1_317216Oprea1_703882MLS000546082SCHEMBL1926263CHEMBL1464316HMS2169N23HMS3309H19STK080713AKOS000374053
Show more names
CCG-321628SMR000161366ST010689AO-548/11903035N-[(4-methoxyphenyl)methyl](4-phenylphenyl)carboxamide287945-52-2
Database identifiers
- CAS
287945-52-2- PubChem CID
- 710674
- ChEMBL
CHEMBL1464316- EC Number
- 169-453-0
- Nikkaji
- J1.337.732D
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 375
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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Related reactions
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Compound notes
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