6-acetyl-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one
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![6-acetyl-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/70bc0d8da7bf4808aac2b099f9733645.png "6-acetyl-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one")
6-acetyl-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one
structure -
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CAS No:
851469-32-4
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Formula:
C21H25N5O2S2
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Chemical Name:
6-acetyl-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one
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Synonyms:
ZINC3354482;AKOS033443302;MCULE-3773180413;AB00730858-01;Z15820038;6-acetyl-2-({[5-cyclohexyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-methyl-3H,4H-thieno[2,3-d]pyrimidin-4-one;851469-32-4
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CAS No:
6-acetyl-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-methyl-3H-thieno[2,3-d]pyrimidin-4-one Basic Attributes
443.6 g/mol
443.14496740 g/mol
Computed Properties
Molecular Weight:443.6
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:443.14496740
Monoisotopic Mass:443.14496740
Topological Polar Surface Area:143
Heavy Atom Count:30
Complexity:712
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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