2-(4-(Azetidin-1-ylmethyl)-3,5-dimethylphenyl)-5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridine
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Basic information
- Standard SMILES
Cc1cc(-c2nc3ccc(C4(c5ccccc5)CC4)nc3s2)cc(C)c1CN1CCC1- InChIKey
SMRWUURWIUGKDT-UHFFFAOYSA-N- Molecular formula
- C27H27N3S
- Average molar mass
- 425.6 g/mol
Names & identifiers
- Preferred name
- 2-(4-(Azetidin-1-ylmethyl)-3,5-dimethylphenyl)-5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridine
- IUPAC
- 2-[4-(azetidin-1-ylmethyl)-3,5-dimethylphenyl]-5-(1-phenylcyclopropyl)-[1,3]thiazolo[5,4-b]pyridine
Names & synonyms
SCHEMBL1662654SMRWUURWIUGKDT-UHFFFAOYSA-N2-(4-(azetidin-1-ylmethyl)-3,5-dimethylphenyl)-5-(1-phenylcyclopropyl)thiazolo[5,4-b]pyridine
Database identifiers
- PubChem CID
- 44599684
Properties
Computed structural propertiesFilling in
- XLogP
- 6.2
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 614
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Related reactions
2 records
Compound notes
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