| CAS Number | 2196183-71-6 |
| Catalog Number | AG01E5BH |
| Chemical Name | 3-((1,5-Dibenzyl-1H-indazol-3-yl)oxy)-N,N-dimethylpropan-1-amine hydrochloride |
| IUPAC Name | 3-(1,5-dibenzylindazol-3-yl)oxy-N,N-dimethylpropan-1-amine;hydrochloride |
| InChI | InChI=1S/C26H29N3O.ClH/c1-28(2)16-9-17-30-26-24-19-23(18-21-10-5-3-6-11-21)14-15-25(24)29(27-26)20-22-12-7-4-8-13-22;/h3-8,10-15,19H,9,16-18,20H2,1-2H3;1H |
| InChI Key | LHILUQKQKYJDKG-UHFFFAOYSA-N |
| MDL Number | MFCD17170188 |
| Molecular Formula | C26H30ClN3O |
| Molecular Weight | 435.9889 |
| SMILES | Cl.C(C1=CC=CC=C1)N1N=C(C2=CC(=CC=C12)CC1=CC=CC=C1)OCCCN(C)C |
| Synonyms | 3-((1,5-Dibenzyl-1H-indazol-3-yl)oxy)-N,N-dimethylpropan-1-amine hydrochloride,
2196183-71-6,
|
| Complexity | 487 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 435.208g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 435.996g/mol |
| Monoisotopic Mass | 435.208g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 30.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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