2-[5-difluoromethoxy-1-(3-methylamino-propyl)-1H-indazol-3-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid tert-butylamide
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Basic information
- Standard SMILES
CNCCCn1nc(-c2cnc3[nH]cc(C(=O)NC(C)(C)C)c3n2)c2cc(OC(F)F)ccc21- InChIKey
YZFOKTIBOAIKMD-UHFFFAOYSA-N- Molecular formula
- C23H27F2N7O2
- Average molar mass
- 471.5 g/mol
Names & identifiers
- Preferred name
- 2-[5-difluoromethoxy-1-(3-methylamino-propyl)-1H-indazol-3-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid tert-butylamide
- IUPAC
- N-tert-butyl-2-[5-(difluoromethoxy)-1-[3-(methylamino)propyl]indazol-3-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
Names & synonyms
2-[5-difluoromethoxy-1-(3-methylamino-propyl)-1H-indazol-3-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid tert-butylamideSCHEMBL14737810
Database identifiers
- PubChem CID
- 71279986
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 695
Related reactions
1 records
Compound notes
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