(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate
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(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate
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CAS No:
730945-91-2
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Formula:
C21H23N3O5S3
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Chemical Name:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate
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Synonyms:
ZINC3377420;AKOS034438654;MCULE-2648085413;Z53860022;{3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}methyl 1-(thiophene-2-sulfonyl)piperidine-4-carboxylate;730945-91-2
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CAS No:
(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Basic Attributes
493.6 g/mol
493.07998436 g/mol
Computed Properties
Molecular Weight:493.6
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:493.07998436
Monoisotopic Mass:493.07998436
Topological Polar Surface Area:170
Heavy Atom Count:32
Complexity:882
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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