Basic information
- Standard SMILES
COc1ccc2nc(NC(=O)C(CC3CCCC3)c3ccc(S(=O)(=O)CC(C)=O)cc3)sc2n1- InChIKey
HUBZELJLLUWLDC-UHFFFAOYSA-N- Molecular formula
- C24H27N3O5S2
- Average molar mass
- 501.6 g/mol
- Monoisotopic mass
- 501.13921332
Names & identifiers
- Preferred name
- 3-cyclopentyl-N-(5-methoxy-thiazolo[5,4-b]pyridin-2-yl)-2-[4-(2-oxo-propane-1-sulfonyl)-phenyl]-propionamide
- IUPAC
- 3-cyclopentyl-N-(5-methoxy-[1,3]thiazolo[5,4-b]pyridin-2-yl)-2-[4-(2-oxopropylsulfonyl)phenyl]propanamide
Names & synonyms
SCHEMBL2660299HUBZELJLLUWLDC-UHFFFAOYSA-N3-cyclopentyl-N-(5-methoxy-thiazolo[5,4-b]pyridin-2-yl)-2-[4-(2-oxo-propane-1-sulfonyl)-phenyl]-propionamide
Database identifiers
- PubChem CID
- 11533435
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 819
Related reactions
2 records
Compound notes
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