2-(12,12-dimethyl-3,5-dioxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-6-yl)acetic acid
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2-(12,12-dimethyl-3,5-dioxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-6-yl)acetic acid
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CAS No:
303041-99-8
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Formula:
C19H18N2O5S
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Chemical Name:
2-(12,12-dimethyl-3,5-dioxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-6-yl)acetic acid
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Synonyms:
Oprea1_406323;ZINC2346460;STK524556;AKOS005458562;(6,6-dimethyl-2,4-dioxo-3-phenyl-3,4,5,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-1(6H)-yl)acetic acid;303041-99-8
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CAS No:
2-(12,12-dimethyl-3,5-dioxo-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-dien-6-yl)acetic acid Basic Attributes
386.4 g/mol
386.09364285 g/mol
Computed Properties
Molecular Weight:386.4
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:386.09364285
Monoisotopic Mass:386.09364285
Topological Polar Surface Area:115
Heavy Atom Count:27
Complexity:648
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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