1H-Indazole, 1-benzyl-6-chloro-3-(2-(dimethylamino)ethoxy)-, monohydrochloride

HCID 200261

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Basic information

CAS: 1472-38-4
Standard SMILES: CN(C)CCOc1nn(Cc2ccccc2)c2cc(Cl)ccc12.Cl
InChIKey: XSXODIMXMTZFHJ-UHFFFAOYSA-N
Molecular formula: C18H21Cl2N3O
Average molar mass: 366.3 g/mol
Monoisotopic mass: 365.1061677

Names & identifiers

Preferred name: 1H-Indazole, 1-benzyl-6-chloro-3-(2-(dimethylamino)ethoxy)-, monohydrochloride
IUPAC: 2-(1-benzyl-6-chloroindazol-3-yl)oxy-N,N-dimethylethanamine;hydrochloride

Names & synonyms

1H-Indazole, 1-benzyl-6-chloro-3-(2-(dimethylamino)ethoxy)-, monohydrochloride1-Benzyl-6-chloro-3-(2-(dimethylamino)ethoxy)-1H-indazole monohydrochloride1472-38-4DTXSID10163610RefChem:238345DTXCID80861012-[(1-Benzyl-6-chloro-1H-indazol-3-yl)oxy]-N,N-dimethylethan-1-amine--hydrogen chloride (1/1)

Database identifiers

CAS: 1472-38-4
PubChem CID: 200261
DTXSID: DTXSID10163610

Properties

Computed structural properties

Topological polar surface area: 30.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 24
Formal charge: 0
Complexity: 362

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