4-amino-6-(4-bromophenyl)-11,13-dimethyl-8-thia-3,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-5-carbonitrile
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4-amino-6-(4-bromophenyl)-11,13-dimethyl-8-thia-3,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-5-carbonitrile
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CAS No:
180519-69-1
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Formula:
C19H13BrN4S
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Chemical Name:
4-amino-6-(4-bromophenyl)-11,13-dimethyl-8-thia-3,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-5-carbonitrile
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Synonyms:
C19H13BrN4S;RSC006475;STL326728;ZINC20841125;AKOS003683925;MCULE-7089654917;2-amino-4-(4-bromophenyl)-7,9-dimethylthieno[2,3-b:4,5-b']dipyridine-3-carbonitrile;180519-69-1
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CAS No:
4-amino-6-(4-bromophenyl)-11,13-dimethyl-8-thia-3,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-5-carbonitrile Basic Attributes
409.3 g/mol
408.00443 g/mol
Computed Properties
Molecular Weight:409.3
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:408.00443
Monoisotopic Mass:408.00443
Topological Polar Surface Area:104
Heavy Atom Count:25
Complexity:543
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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