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[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate

[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate structure

CAS No:
750641-70-4
Formula:
C21H19NO5S
Chemical Name:
[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate
Synonyms:
MLS000053488;SMR000063594;MLS002635649;CHEMBL1556227;BDBM44636;cid_2121276;HMS2364E22;ZINC2657521;AKOS002472177;MCULE-8422995580;[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate;SR-01000053619;SR-01000053619-1;Z18362160;piperonylic acid [2-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-keto-ethyl] ester;[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl] 1,3-benzodioxole-5-carboxylate;1,3-benzodioxole-5-carboxylic acid [2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-oxoethyl] ester;2-{2,5-dimethyl-1-[(thiophen-2-yl)methyl]-1H-pyrrol-3-yl}-2-oxoethyl 2H-1,3-benzodioxole-5-carboxylate;750641-70-4

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[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate Basic Attributes

Molecular Weight：

397.4 g/mol

Exact Mass：

397.09839388 g/mol

Characteristics

PSA：

95 Å²

Computed Properties

Molecular Weight:397.4
XLogP3:3.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:397.09839388
Monoisotopic Mass:397.09839388
Topological Polar Surface Area:95
Heavy Atom Count:28
Complexity:587
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate

Basic Attributes
Characteristics
Computed Properties
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