Basic information
- Standard SMILES
Cc1oc(-c2ccc(C(=O)NCc3cccnc3)cc2)nc1CS(=O)(=O)c1ccc(C(C)(C)C)cc1- InChIKey
STRZWCVRJUENOO-UHFFFAOYSA-N- Molecular formula
- C28H29N3O4S
- Average molar mass
- 503.6 g/mol
Names & identifiers
- Preferred name
- 4-(4-{[(4-tert-Butylphenyl)sulfonyl]methyl}-5-methyl-1,3-oxazol-2-yl)-N-(3-pyridinylmethyl)benzamide
- IUPAC
- 4-[4-[(4-tert-butylphenyl)sulfonylmethyl]-5-methyl-1,3-oxazol-2-yl]-N-(pyridin-3-ylmethyl)benzamide
Names & synonyms
SCHEMBL12469495STRZWCVRJUENOO-UHFFFAOYSA-N4-(4-{[(4-tert-Butylphenyl)sulfonyl]methyl}-5-methyl-1,3-oxazol-2-yl)-N-(3-pyridinylmethyl)benzamide
Database identifiers
- PubChem CID
- 56963458
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 821
Related reactions
2 records
Compound notes
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