Basic information
- Standard SMILES
CCOC(=O)C(C)(Cl)Cc1c(C#N)cnn1-c1nn2c(c1Cl)CCCC2- InChIKey
WMXVICHTEPNFON-UHFFFAOYSA-N- Molecular formula
- C17H19Cl2N5O2
- Average molar mass
- 396.3 g/mol
Names & identifiers
- Preferred name
- 2Chlor-3-[1-(3-chlor-4,5,6,7-tetrahydropyrazolo-[1,5-a]-pyridin-2-yl)-4-cyan-5-pyrazolyl]-2-methyl-propionic acid ethyl ester
- IUPAC
- ethyl 2-chloro-3-[1-(3-chloro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-cyanopyrazol-5-yl]-2-methylpropanoate
Names & synonyms
SCHEMBL6980544WMXVICHTEPNFON-UHFFFAOYSA-N2chlor-3-[1-(3-chlor-4,5,6,7-tetrahydropyrazolo-[1,5-a]-pyridin-2-yl)-4-cyan-5-pyrazolyl]-2-methyl-propionic acid ethyl ester
Database identifiers
- PubChem CID
- 57322157
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 85.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 585
Related reactions
1 records
Compound notes
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