1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-, 1,1-dimethylethyl ester
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![1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-, 1,1-dimethylethyl ester structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2b305ec70da442cc882e2bae566e4535.png "1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-, 1,1-dimethylethyl ester")
1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-, 1,1-dimethylethyl ester
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CAS No:
629662-57-3
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Formula:
C25H29N3O2
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Chemical Name:
1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-, 1,1-dimethylethyl ester
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Synonyms:
6-(benzoylamino-methyl)-2H-pyridazin-3-one; 6-(benzyl(methyl)amino)-1,1-dimethyl-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylic acid ethyl ester; Benzamide,N-[(1,6-dihydro-6-oxo-3-pyridazinyl)methyl]; 6-(benzylmethylamino)-3-(cyanodimethylmethyl)indole-1-carboxylic acid tert-butyl ester;
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CAS No:
1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-6-[methyl(phenylmethyl)amino]-, 1,1-dimethylethyl ester Basic Attributes
403.51700
403.22597718
Computed Properties
Molecular Weight:403.5
XLogP3:5.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:403.22597718
Monoisotopic Mass:403.22597718
Topological Polar Surface Area:58.3
Heavy Atom Count:30
Complexity:653
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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