 Home > Encyclopedia > 6-(1,3-benzodioxol-5-yl)-2-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene

6-(1,3-benzodioxol-5-yl)-2-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene

6-(1,3-benzodioxol-5-yl)-2-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene structure

CAS No:
731003-93-3
Formula:
C27H28N4O4S
Chemical Name:
6-(1,3-benzodioxol-5-yl)-2-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene
Synonyms:
ZINC3289757;AKOS034467603;MCULE-9888239385;AB00980235-01;Z56948421;6-(2H-1,3-benzodioxol-5-yl)-2-[3-(piperidine-1-sulfonyl)phenyl]-1,3,4-triazatricyclo[5.4.1.0^{4,12}]dodeca-2,5,7(12)-triene;731003-93-3

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6-(1,3-benzodioxol-5-yl)-2-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene Basic Attributes

Molecular Weight：

504.6 g/mol

Exact Mass：

504.18312656 g/mol

Characteristics

PSA：

86.4 Å²

Computed Properties

Molecular Weight:504.6
XLogP3:4.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:504.18312656
Monoisotopic Mass:504.18312656
Topological Polar Surface Area:86.4
Heavy Atom Count:36
Complexity:893
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(1,3-benzodioxol-5-yl)-2-(3-piperidin-1-ylsulfonylphenyl)-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene

Basic Attributes
Characteristics
Computed Properties

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