N-(4-methoxybenzyl)-5-(3-(6-(2-methylpiperidin-1-yl)pyrazin-2-yl)-1-tosyl-1H-indol-5-yl)-1,3,4-oxadiazol-2-amine
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COc1ccc(CNc2nnc(-c3ccc4c(c3)c(-c3cncc(N5CCCCC5C)n3)cn4S(=O)(=O)c3ccc(C)cc3)o2)cc1- InChIKey
GZSPWZMNFMSURG-UHFFFAOYSA-N- Molecular formula
- C35H35N7O4S
- Average molar mass
- 649.8 g/mol
Names & identifiers
- Preferred name
- N-(4-methoxybenzyl)-5-(3-(6-(2-methylpiperidin-1-yl)pyrazin-2-yl)-1-tosyl-1H-indol-5-yl)-1,3,4-oxadiazol-2-amine
- IUPAC
- N-[(4-methoxyphenyl)methyl]-5-[1-(4-methylphenyl)sulfonyl-3-[6-(2-methylpiperidin-1-yl)pyrazin-2-yl]indol-5-yl]-1,3,4-oxadiazol-2-amine
Names & synonyms
SCHEMBL12615368GZSPWZMNFMSURG-UHFFFAOYSA-NN-(4-methoxybenzyl)-5-(3-(6-(2-methylpiperidin-1-yl)pyrazin-2-yl)-1-tosyl-1H-indol-5-yl)-1,3,4-oxadiazol-2-amine
Database identifiers
- PubChem CID
- 68328232
Properties
Computed structural propertiesFilling in
- XLogP
- 6.1
- Topological polar surface area
- 137 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 9
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 1,110
Related reactions
2 records
Compound notes
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