N-butyl-5-chloroindazole-1-carboxamide
Basic information
- CAS
24240-10-6- Standard SMILES
CCCCNC(=O)n1ncc2cc(Cl)ccc21- InChIKey
WOVDQXQWMYKPDP-UHFFFAOYSA-N- Molecular formula
- C12H14ClN3O
- Average molar mass
- 251.71 g/mol
- Monoisotopic mass
- 251.0825398
Names & identifiers
- Preferred name
- N-butyl-5-chloroindazole-1-carboxamide
- IUPAC
- N-butyl-5-chloroindazole-1-carboxamide
Names & synonyms
24240-10-6NSC108650DTXSID30947055NSC-108650N-Butyl-5-chloro-1H-indazole-1-carboximidic acid
Database identifiers
- CAS
24240-10-6- PubChem CID
- 268458
- DTXSID
DTXSID30947055
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 274
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Compound notes
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