 Home > Encyclopedia > 3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-12,12-dimethyl-7-phenyl-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

3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-12,12-dimethyl-7-phenyl-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

3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-12,12-dimethyl-7-phenyl-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:
836652-29-0
Formula:
C26H21FN4O3S2
Chemical Name:
3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-12,12-dimethyl-7-phenyl-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:
C26H21FN4O3S2;ZINC2254132;STK553039;AKOS005480311;MCULE-4023084385;1-((2-(4-fluorophenyl)-2-oxoethyl)thio)-7,7-dimethyl-4-phenyl-6,7-dihydro-4H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(9H)-one;1-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;836652-29-0

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3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-12,12-dimethyl-7-phenyl-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：

520.6 g/mol

Exact Mass：

520.10391105 g/mol

Characteristics

PSA：

131 Å²

Computed Properties

Molecular Weight:520.6
XLogP3:4.8
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:520.10391105
Monoisotopic Mass:520.10391105
Topological Polar Surface Area:131
Heavy Atom Count:36
Complexity:851
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-12,12-dimethyl-7-phenyl-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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