N-hexyl-12,12-dimethyl-6-(propanoylamino)-11-oxa-4-thia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxamide
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N-hexyl-12,12-dimethyl-6-(propanoylamino)-11-oxa-4-thia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxamide
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CAS No:
797764-61-5
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Formula:
C22H31N3O3S
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Chemical Name:
N-hexyl-12,12-dimethyl-6-(propanoylamino)-11-oxa-4-thia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxamide
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Synonyms:
ZINC2368957;STK546348;AKOS005474787;MCULE-7889759071;797764-61-5;N-hexyl-7,7-dimethyl-3-(propanoylamino)-7,8-dihydro-5H-pyrano[4,3-b]thieno[3,2-e]pyridine-2-carboxamide
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CAS No:
N-hexyl-12,12-dimethyl-6-(propanoylamino)-11-oxa-4-thia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxamide Basic Attributes
417.6 g/mol
417.20861303 g/mol
Computed Properties
Molecular Weight:417.6
XLogP3:4.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:417.20861303
Monoisotopic Mass:417.20861303
Topological Polar Surface Area:109
Heavy Atom Count:29
Complexity:586
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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