 Home > Encyclopedia > N-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]-1,3-benzodioxole-5-carboxamide

N-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]-1,3-benzodioxole-5-carboxamide

N-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]-1,3-benzodioxole-5-carboxamide structure

CAS No:
522605-33-0
Formula:
C21H19N3O4S2
Chemical Name:
N-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]-1,3-benzodioxole-5-carboxamide
Synonyms:
ZINC3245234;AKOS034460536;MCULE-9298682435;Z56844522;522605-33-0;N-({[12-oxo-11-(prop-2-en-1-yl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl}methyl)-2H-1,3-benzodioxole-5-carboxamide

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N-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]-1,3-benzodioxole-5-carboxamide Basic Attributes

Molecular Weight：

441.5 g/mol

Exact Mass：

441.08169844 g/mol

Characteristics

PSA：

134 Å²

Computed Properties

Molecular Weight:441.5
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:441.08169844
Monoisotopic Mass:441.08169844
Topological Polar Surface Area:134
Heavy Atom Count:30
Complexity:748
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-[(12-oxo-11-prop-2-enyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]-1,3-benzodioxole-5-carboxamide

Basic Attributes
Characteristics
Computed Properties

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