Basic information
- CAS
920736-62-5- Standard SMILES
Cc1cc(NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)no1- InChIKey
ACBUSZGGVRRJFY-UHFFFAOYSA-N- Molecular formula
- C21H18FN3O2
- Average molar mass
- 363.4 g/mol
- Monoisotopic mass
- 363.13830499
Names & identifiers
- Preferred name
- 3-(2-(4-fluorophenyl)-1H-indol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
- IUPAC
- 3-[2-(4-fluorophenyl)-1H-indol-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
Names & synonyms
920736-62-53-[2-(4-fluorophenyl)-1H-indol-3-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide3-(2-(4-fluorophenyl)-1H-indol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamideRefChem:490467868-187-9AKOS033134417EN300-27375158Z117234158
Database identifiers
- CAS
920736-62-5- PubChem CID
- 16369166
- EC Number
- 868-187-9
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 70.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 512
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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