methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate
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methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate
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CAS No:
609782-48-1
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Formula:
C18H14N2O5S
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Chemical Name:
methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate
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Synonyms:
MLS001214265;SMR000543853;methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate;CHEMBL1342433;BDBM66772;cid_1873236;HMS2880C23;STK851865;AKOS002093023;AKOS005630400;ZINC100101950;MCULE-7580576697;methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate;ST50766069;SR-01000293983;SR-01000293983-1;4-keto-3-piperonyl-2-thioxo-1H-quinazoline-7-carboxylic acid methyl ester;3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylic acid methyl ester;609782-48-1;methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxylate;methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanyl-3,4-dihydroquinazoline-7-carboxylate;methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydro-7-quinazolinecarboxylate;methyl 3-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)-4-oxo-2-thioxo-1,3-dihydroqu inazoline-7-carboxylate
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CAS No:
methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxylate Basic Attributes
370.4 g/mol
370.06234272 g/mol
Computed Properties
Molecular Weight:370.4
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:370.06234272
Monoisotopic Mass:370.06234272
Topological Polar Surface Area:109
Heavy Atom Count:26
Complexity:600
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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