N-benzhydryl-2-[(5-butyl-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]acetamide
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N-benzhydryl-2-[(5-butyl-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]acetamide
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CAS No:
488129-71-1
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Formula:
C30H33N3O2S2
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Chemical Name:
N-benzhydryl-2-[(5-butyl-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]acetamide
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Synonyms:
ZINC2331176;STK547126;AKOS005475362;MCULE-6266503610;2-[(2-butyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]-N-(diphenylmethyl)acetamide;488129-71-1
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CAS No:
N-benzhydryl-2-[(5-butyl-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]acetamide Basic Attributes
531.7 g/mol
531.20141965 g/mol
Computed Properties
Molecular Weight:531.7
XLogP3:7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:531.20141965
Monoisotopic Mass:531.20141965
Topological Polar Surface Area:118
Heavy Atom Count:37
Complexity:722
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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