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Home > Encyclopedia > ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate

ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate

ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate structure

ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate 

structure
  • CAS No:

    497082-08-3

  • Formula:

    C23H25N3O4S2

  • Chemical Name:

    ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate

  • Synonyms:

    ethyl 4-[3-(5,6-dimethyl-4-oxo-3-prop-2-enyl-3-hydrothiopheno[2,3-d]pyrimidin- 2-ylthio)propanoylamino]benzoate;ZINC702801;SBB083682;STL001295;AKOS002176436;MCULE-2001944869;ST50062063;AF-399/41945544;ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate;ethyl 4-[(3-{[5,6-dimethyl-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanoyl)amino]benzoate

ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate Basic Attributes

471.5923

471.129

Characteristics

142

4.3

Computed Properties

Molecular Weight:471.6
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:471.12864863
Monoisotopic Mass:471.12864863
Topological Polar Surface Area:142
Heavy Atom Count:32
Complexity:752
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of ethyl 4-({3-[(3-allyl-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoyl}amino)benzoate

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