12,12-dimethyl-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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12,12-dimethyl-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
structure -
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CAS No:
497248-10-9
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Formula:
C21H25N3OS3
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Chemical Name:
12,12-dimethyl-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
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Synonyms:
ZINC1819333;STK842020;AKOS005625459;MCULE-6822775382;497248-10-9;6,6-dimethyl-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-5,8-dihydro-6H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
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CAS No:
12,12-dimethyl-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine Basic Attributes
431.6 g/mol
431.11597595 g/mol
Computed Properties
Molecular Weight:431.6
XLogP3:5.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:431.11597595
Monoisotopic Mass:431.11597595
Topological Polar Surface Area:140
Heavy Atom Count:28
Complexity:527
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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