ethyl 5-[2-[(2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
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ethyl 5-[2-[(2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
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CAS No:
956706-47-1
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Formula:
C20H22N4O7S2
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Chemical Name:
ethyl 5-[2-[(2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
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Synonyms:
ZINC2657617;AKOS034827068;MCULE-2417629917;Z56990919;956706-47-1;ethyl 5-(2-{[(2S)-2-(2lambda4,1,3-benzothiadiazole-4-sulfonamido)propanoyl]oxy}acetyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
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CAS No:
ethyl 5-[2-[(2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoyl]oxyacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Basic Attributes
494.5 g/mol
494.09299140 g/mol
Computed Properties
Molecular Weight:494.5
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:11
Exact Mass:494.09299140
Monoisotopic Mass:494.09299140
Topological Polar Surface Area:194
Heavy Atom Count:33
Complexity:850
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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