3-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylamino)propanoic acid
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![3-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylamino)propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a150ccac28d04244953d39d85a55cdfb.png "3-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylamino)propanoic acid")
3-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylamino)propanoic acid
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CAS No:
690697-36-0
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Formula:
C12H13N3O2S
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Chemical Name:
3-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylamino)propanoic acid
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Synonyms:
3-(2,3-Dihydro-1H-8-thia-5,7-diaza-cyclopenta[a]inden-4-ylamino)-propionic acid;690697-36-0;3-((6,7-Dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)amino)propanoic acid;3-(5,6,7-trihydrocyclopenta[1,2-d]pyrimidino[4,5-b]thiophen-4-ylamino)propanoi c acid;ZINC2509379;SBB027939;STL336318;AKOS000300856;MCULE-7188810869;ST50020578;3-(2,3-dihydro-1 h-8-thia-5,7-diaza-cyclopenta[a]inden-4-ylamino)-propionic acid;3-(2,3-Dihydro-1H-8-thia-5,7-diaza-cyclopenta[a]inden-4-ylamino)propanoic acid;3-(6,7-dihydro-5h-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-ylamino)-propionic acid;N-(6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-yl)-beta-alanine;3-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylamino)propanoic acid
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CAS No:
3-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-ylamino)propanoic acid Basic Attributes
263.32 g/mol
263.07284784 g/mol
Computed Properties
Molecular Weight:263.32
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:263.07284784
Monoisotopic Mass:263.07284784
Topological Polar Surface Area:103
Heavy Atom Count:18
Complexity:328
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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