2-O-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
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![2-O-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d3935930561243b38c91a38f4b365dbf.png "2-O-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate")
2-O-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
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CAS No:
764696-18-6
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Formula:
C20H22N2O7
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Chemical Name:
2-O-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
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Synonyms:
ZINC2620699;AKOS033502603;MCULE-2294955268;Z16503280;2-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl 4-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate;764696-18-6
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CAS No:
2-O-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 4-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Basic Attributes
402.4 g/mol
402.14270105 g/mol
Computed Properties
Molecular Weight:402.4
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:402.14270105
Monoisotopic Mass:402.14270105
Topological Polar Surface Area:116
Heavy Atom Count:29
Complexity:614
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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