[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate
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![[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b2b0c1bef9854d8bb21a5b53cd38042f.png "[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate")
[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate
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CAS No:
956743-66-1
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Formula:
C19H18N4O7S2
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Chemical Name:
[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate
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Synonyms:
ZINC2632622;AKOS034826854;MCULE-2697778022;Z56973028;[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]methyl (2S)-2-(2lambda4,1,3-benzothiadiazole-4-sulfonamido)propanoate;956743-66-1
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CAS No:
[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl] (2S)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)propanoate Basic Attributes
478.5 g/mol
478.06169127 g/mol
Computed Properties
Molecular Weight:478.5
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:8
Exact Mass:478.06169127
Monoisotopic Mass:478.06169127
Topological Polar Surface Area:182
Heavy Atom Count:32
Complexity:793
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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