Basic information
- CAS
304685-22-1- Standard SMILES
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccn2)cc1- InChIKey
YJCSMGXTSYXQOG-UHFFFAOYSA-N- Molecular formula
- C14H15N3O3S
- Average molar mass
- 305.35 g/mol
- Monoisotopic mass
- 305.08341252
Names & identifiers
- Preferred name
- N-[4-(pyridin-2-ylmethylsulfamoyl)phenyl]acetamide
- IUPAC
- N-[4-(pyridin-2-ylmethylsulfamoyl)phenyl]acetamide
- English name
- N-{4-[(pyridin-2-ylmethyl)sulfamoyl]phenyl}acetamide
- Molecular formula
- C14H15N3O3S
- Molecular weight
- 305.35
Names & synonyms
N-(4-{[(pyridin-2-ylmethyl)amino]sulfonyl}phenyl)acetamideOprea1_385668Oprea1_585333MLS000704830N-[4-(pyridin-2-ylmethylsulfamoyl)phenyl]acetamideIFLab1_001077N-{4-[(pyridin-2-ylmethyl)sulfamoyl]phenyl}acetamideCHEMBL1422984HMS1415A21HMS2544H21STK072038AKOS000806686
Show more names
Acetamide, N-[4-[[(2-pyridinylmethyl)amino]sulfonyl]phenyl]-
IDI1_008944SMR000230791ST011806AB00089013-01AG-690/11635660N-(4-{[(2-pyridylmethyl)amino]sulfonyl}phenyl)acetamideN-(4-{[(PYRIDIN-2-YL)METHYL]SULFAMOYL}PHENYL)ACETAMIDEN-(4-((PYRIDIN-2-YLMETHYL)-SULFAMOYL)-PHENYL)-ACETAMIDE
Database identifiers
- CAS
304685-22-1- PubChem CID
- 720105
- ChEMBL
CHEMBL1422984- EC Number
- 163-553-8
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 439
Physicochemical properties
- Density
- 1.344 · 1.344±0.06 g/cm3(Predicted)
- pka
- 9 · 9+-.0.50(Predicted)
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, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, 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%)
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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