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(4-oxopyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate

(4-oxopyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate structure

CAS No:
956385-84-5
Formula:
C21H19N3O5S
Chemical Name:
(4-oxopyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate
Synonyms:
MLS000394573;CHEMBL1389020;HMS2729K20;ZINC3350378;AKOS034827901;MCULE-3607665284;SMR000262013;AB00625360-06;Z57983852;{13-oxo-8-thia-1,10-diazatricyclo[7.4.0.0^{2,7}]trideca-2(7),3,5,9,11-pentaen-11-yl}methyl (2S)-2-[(furan-2-yl)formamido]-3-methylbutanoate;956385-84-5

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(4-oxopyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate Basic Attributes

Molecular Weight：

425.5 g/mol

Exact Mass：

425.10454189 g/mol

Characteristics

PSA：

127 Å²

Computed Properties

Molecular Weight:425.5
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:425.10454189
Monoisotopic Mass:425.10454189
Topological Polar Surface Area:127
Heavy Atom Count:30
Complexity:781
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (4-oxopyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate

Basic Attributes
Characteristics
Computed Properties
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