Basic information
- Standard SMILES
CC(C)(O)c1ccc(C(=O)Nc2nc3ccc(-c4ccnc(Cl)c4)nc3s2)cc1- InChIKey
VCTRILDKJSNITE-UHFFFAOYSA-N- Molecular formula
- C21H17ClN4O2S
- Average molar mass
- 424.9 g/mol
- Monoisotopic mass
- 424.0760747
Names & identifiers
- Preferred name
- N-(5-(2-chloropyridin-4-yl)thiazolo[5,4-b]pyridin-2-yl)-4-(2-hydroxypropan-2-yl)benzamide
- IUPAC
- N-[5-(2-chloro-4-pyridinyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]-4-(2-hydroxypropan-2-yl)benzamide
Names & synonyms
SCHEMBL2743331VCTRILDKJSNITE-UHFFFAOYSA-NN-(5-(2-chloropyridin-4-yl)thiazolo[5,4-b]pyridin-2-yl)-4-(2-hydroxypropan-2-yl)benzamide
Database identifiers
- PubChem CID
- 44548455
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 587
Related reactions
2 records
Compound notes
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