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Home > Encyclopedia > 12,12-dimethyl-4-(4-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

12,12-dimethyl-4-(4-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

12,12-dimethyl-4-(4-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

12,12-dimethyl-4-(4-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one 

structure
  • CAS No:

    500274-52-2

  • Formula:

    C28H30N2O2S3

  • Chemical Name:

    12,12-dimethyl-4-(4-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

  • Synonyms:

    ZINC1833721;STK942429;AKOS005671247;MCULE-2729929846;500274-52-2;6,6-dimethyl-3-(4-methylphenyl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

12,12-dimethyl-4-(4-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

522.8 g/mol

522.14694172 g/mol

Characteristics

121 Ų

Computed Properties

Molecular Weight:522.8
XLogP3:7.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:522.14694172
Monoisotopic Mass:522.14694172
Topological Polar Surface Area:121
Heavy Atom Count:35
Complexity:787
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 12,12-dimethyl-4-(4-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

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