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Home > Encyclopedia > 2-[(14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone

2-[(14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone

2-[(14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone structure

2-[(14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone 

structure
  • CAS No:

    799795-38-3

  • Formula:

    C21H19N5O4S3

  • Chemical Name:

    2-[(14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone

  • Synonyms:

    C21H19N5O4S3;ZINC2220586;STK549458;AKOS005477241;MCULE-2940261917;2-{[10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-(4-nitrophenyl)ethanone;799795-38-3

2-[(14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone Basic Attributes

501.6 g/mol

501.05991762 g/mol

Characteristics

194 Ų

Computed Properties

Molecular Weight:501.6
XLogP3:5.1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:5
Exact Mass:501.05991762
Monoisotopic Mass:501.05991762
Topological Polar Surface Area:194
Heavy Atom Count:33
Complexity:763
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-[(14,14-dimethyl-7-methylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone

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