2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide
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2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide
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CAS No:
566195-31-1
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Formula:
C26H25N3O3S2
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Chemical Name:
2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide
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Synonyms:
ZINC2632179;AKOS033680826;MCULE-9913160555;Z19407326;2-({11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-10-yl}sulfanyl)-N-[(4-methoxyphenyl)methyl]acetamide;566195-31-1
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CAS No:
2-[(11-benzyl-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide Basic Attributes
491.6 g/mol
491.13373402 g/mol
Computed Properties
Molecular Weight:491.6
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:491.13373402
Monoisotopic Mass:491.13373402
Topological Polar Surface Area:125
Heavy Atom Count:34
Complexity:764
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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