(4S,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid
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(4S,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid
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CAS No:
155782-52-8
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Formula:
C6H10N2O2S
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Chemical Name:
(4S,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid
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Synonyms:
155782-52-8;(4S,6R)-6-METHYL-2-THIOXOHEXAHYDROPYRIMIDINE-4-CARBOXYLIC ACID;rac-(4S,6R)-6-methyl-2-thioxohexahydropyrimidine-4-carboxylic acid;1931958-05-2;(4S,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid;DTXSID00364139;ZINC1456650;MFCD08060073;AKOS006281002;MCULE-3527131237;BS-40958;Y-3600;trans-6-Methyl-2-thioxohexahydropyrimidine-4-carboxylic acid;(4S,6R)-6-Methyl-2-sulfanylidenehexahydropyrimidine-4-carboxylic acid
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CAS No:
(4S,6R)-6-methyl-2-sulfanylidene-1,3-diazinane-4-carboxylic acid Basic Attributes
174.22 g/mol
174.04629874 g/mol
DTXSID00364139
Computed Properties
Molecular Weight:174.22
XLogP3:0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:174.04629874
Monoisotopic Mass:174.04629874
Topological Polar Surface Area:93.4
Heavy Atom Count:11
Complexity:195
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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