Basic information
- CAS
651295-45-3- Standard SMILES
Cc1ccc(OCC(=O)Nc2ccc(S(=O)(=O)N3CCCC3)cc2)c(C)c1- InChIKey
KNACDWDMDGOLBF-UHFFFAOYSA-N- Molecular formula
- C20H24N2O4S
- Average molar mass
- 388.5 g/mol
- Monoisotopic mass
- 388.14567842
Names & identifiers
- Preferred name
- 2-(2,4-dimethylphenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide
- IUPAC
- 2-(2,4-dimethylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
- English name
- 2-(2,4-dimethylphenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide
- Molecular formula
- C20H24N2O4S
- Molecular weight
- 388.48
Names & synonyms
2-(2,4-dimethylphenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide2-(2,4-dimethylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamideSTK122460AKOS000496189AN-329/42158777SR-01000366031SR-01000366031-12-(2,4-dimethylphenoxy)-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]acetamideAcetamide, 2-(2,4-dimethylphenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-
Database identifiers
- CAS
651295-45-3- PubChem CID
- 1015557
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 84.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 590
Physicochemical properties
- Density
- 1.29 · 1.290±0.06 g/cm3(Predicted)
- pka
- 12.65 · 12.65±0.70(Predicted)
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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