1H-Indazole, 1-(p-chlorobenzyl)-3-(2-(dimethylamino)ethoxy)-, monohydrochloride
Basic information
- CAS
1472-28-2- Standard SMILES
CN(C)CCOc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Cl- InChIKey
GTCSDHMEFAOGFL-UHFFFAOYSA-N- Molecular formula
- C18H21Cl2N3O
- Average molar mass
- 366.3 g/mol
- Monoisotopic mass
- 365.1061677
Names & identifiers
- Preferred name
- 1H-Indazole, 1-(p-chlorobenzyl)-3-(2-(dimethylamino)ethoxy)-, monohydrochloride
- IUPAC
- 2-[1-[(4-chlorophenyl)methyl]indazol-3-yl]oxy-N,N-dimethylethanamine;hydrochloride
Names & synonyms
1H-Indazole, 1-(p-chlorobenzyl)-3-(2-(dimethylamino)ethoxy)-, monohydrochloride1-(p-Chlorobenzyl)-3-(2-(dimethylamino)ethoxy)-1H-indazole monohydrochloride1472-28-2DTXSID20163606RefChem:238340DTXCID10860972-({1-[(4-Chlorophenyl)methyl]-1H-indazol-3-yl}oxy)-N,N-dimethylethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
1472-28-2- PubChem CID
- 200253
- DTXSID
DTXSID20163606
Properties
Computed structural properties
- Topological polar surface area
- 30.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 360
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Compound notes
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