N-(1,3-benzodioxol-5-ylmethyl)-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
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N-(1,3-benzodioxol-5-ylmethyl)-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
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CAS No:
796091-70-8
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Formula:
C23H26N4O2S
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Chemical Name:
N-(1,3-benzodioxol-5-ylmethyl)-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine
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Synonyms:
ZINC3343587;AKOS034153850;MCULE-3972232611;Z31193243;796091-70-8;N-[(2H-1,3-benzodioxol-5-yl)methyl]-10-[(piperidin-1-yl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraen-12-amine
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CAS No:
N-(1,3-benzodioxol-5-ylmethyl)-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-amine Basic Attributes
422.5 g/mol
422.17764726 g/mol
Computed Properties
Molecular Weight:422.5
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:422.17764726
Monoisotopic Mass:422.17764726
Topological Polar Surface Area:87.8
Heavy Atom Count:30
Complexity:592
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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