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4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline
4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline
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![4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a1303c3b1aef4451919e87a73060f6ec.png "4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline")
4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline
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CAS No:
3974-60-5
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Formula:
C17H17N3S
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Chemical Name:
4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline
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Synonyms:
MLS000756349;3974-60-5;NSC165701;CHEMBL1329581;DTXSID90304423;ZINC1649010;ZINC04627852;NSC-165701;SMR000528692;4-[(5,5,1-ij]quinolin-2-ylmethyl)sulfanyl]aniline
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CAS No:
4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline Basic Attributes
295.4 g/mol
295.11431873 g/mol
165701
DTXSID90304423
Computed Properties
Molecular Weight:295.4
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:295.11431873
Monoisotopic Mass:295.11431873
Topological Polar Surface Area:69.1
Heavy Atom Count:21
Complexity:356
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-(1,3-diazatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-2-ylmethylsulfanyl)aniline
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