 Home > Encyclopedia > 7-benzyl-3-ethyl-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

7-benzyl-3-ethyl-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

7-benzyl-3-ethyl-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one structure

CAS No:
328068-96-8
Formula:
C21H22N4O2S
Chemical Name:
7-benzyl-3-ethyl-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Synonyms:
Oprea1_723470;ZINC2208044;STK741097;AKOS005523323;MCULE-5816175010;328068-96-8;4-benzyl-1-ethyl-7,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

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7-benzyl-3-ethyl-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one Basic Attributes

Molecular Weight：

394.5 g/mol

Exact Mass：

394.14634713 g/mol

Characteristics

PSA：

88.5 Å²

Computed Properties

Molecular Weight:394.5
XLogP3:3.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:394.14634713
Monoisotopic Mass:394.14634713
Topological Polar Surface Area:88.5
Heavy Atom Count:28
Complexity:611
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-benzyl-3-ethyl-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

Basic Attributes
Characteristics
Computed Properties

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