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Home > Encyclopedia > 2-[[5-(3,5-dimethylpyrazol-1-yl)-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]-1-pyrrolidin-1-ylethanone

2-[[5-(3,5-dimethylpyrazol-1-yl)-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]-1-pyrrolidin-1-ylethanone

2-[[5-(3,5-dimethylpyrazol-1-yl)-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]-1-pyrrolidin-1-ylethanone structure

2-[[5-(3,5-dimethylpyrazol-1-yl)-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]-1-pyrrolidin-1-ylethanone 

structure
  • CAS No:

    850750-65-1

  • Formula:

    C22H27N5O2S2

  • Chemical Name:

    2-[[5-(3,5-dimethylpyrazol-1-yl)-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]-1-pyrrolidin-1-ylethanone

  • Synonyms:

    ZINC2423095;STL313319;AKOS022102461;MCULE-8271688409;2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone;850750-65-1

2-[[5-(3,5-dimethylpyrazol-1-yl)-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]-1-pyrrolidin-1-ylethanone Basic Attributes

457.6 g/mol

457.16061747 g/mol

Characteristics

127 Ų

Computed Properties

Molecular Weight:457.6
XLogP3:3.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:457.16061747
Monoisotopic Mass:457.16061747
Topological Polar Surface Area:127
Heavy Atom Count:31
Complexity:676
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-[[5-(3,5-dimethylpyrazol-1-yl)-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]-1-pyrrolidin-1-ylethanone

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