Basic information
- Standard SMILES
Cc1ccc(N(CC(=O)N(CCO)Cc2ccccn2)S(=O)(=O)c2ccc(C(C)(C)C)cc2)cn1- InChIKey
VGSIIGDLGFUUOE-UHFFFAOYSA-N- Molecular formula
- C26H32N4O4S
- Average molar mass
- 496.6 g/mol
Names & identifiers
- Preferred name
- 2-[(4-tert-Butyl-benzenesulfonyl)-(6-methyl-pyridin-3-yl)-amino]-N-(2-hydroxy-ethyl)-N-pyridin-2-ylmethyl-acetamide
- IUPAC
- 2-[(4-tert-butylphenyl)sulfonyl-(6-methyl-3-pyridinyl)amino]-N-(2-hydroxyethyl)-N-(pyridin-2-ylmethyl)acetamide
Names & synonyms
SCHEMBL1038431VGSIIGDLGFUUOE-UHFFFAOYSA-N2-[(4-tert-Butyl-benzenesulfonyl)-(6-methyl-pyridin-3-yl)-amino]-N-(2-hydroxy-ethyl)-N-pyridin-2-ylmethyl-acetamide
Database identifiers
- PubChem CID
- 58978461
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 771
Related reactions
2 records
Compound notes
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