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Home > Encyclopedia > methyl 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetate

methyl 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetate

methyl 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetate structure

methyl 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetate 

structure
  • CAS No:

    500194-47-8

  • Formula:

    C16H20N2O3S2

  • Chemical Name:

    methyl 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetate

  • Synonyms:

    MLS001164817;CHEMBL1499387;HMS2871L12;ZINC2359677;STK547933;AKOS005476045;MCULE-9226007861;SMR000539886;500194-47-8;methyl [(2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetate

methyl 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetate Basic Attributes

352.5 g/mol

352.09153485 g/mol

Characteristics

115 Ų

7.4 [ug/mL]

Computed Properties

Molecular Weight:352.5
XLogP3:3.5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:352.09153485
Monoisotopic Mass:352.09153485
Topological Polar Surface Area:115
Heavy Atom Count:23
Complexity:449
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]acetate

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