Basic information
- Standard SMILES
O=C(Nc1ccnc(Nc2cnn(C3CCOCC3)c2)c1)c1c(Cl)cccc1Cl- InChIKey
HOIBBJFZANIUHW-UHFFFAOYSA-N- Molecular formula
- C20H19Cl2N5O2
- Average molar mass
- 432.3 g/mol
- Monoisotopic mass
- 431.0915803
Names & identifiers
- Preferred name
- 2,6-dichloro-N-(2-(1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-ylamino)pyridin-4-yl)benzamide
- IUPAC
- 2,6-dichloro-N-[2-[[1-(oxan-4-yl)pyrazol-4-yl]amino]-4-pyridinyl]benzamide
Names & synonyms
SCHEMBL1706873HOIBBJFZANIUHW-UHFFFAOYSA-N2,6-dichloro-N-(2-(1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-4-ylamino)pyridin-4-yl)benzamide
Database identifiers
- PubChem CID
- 59618109
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 541
Related reactions
2 records
Compound notes
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