N-(12,12-dimethyl-5-nonyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)-2-nitrobenzamide
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N-(12,12-dimethyl-5-nonyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)-2-nitrobenzamide
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CAS No:
303959-66-2
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Formula:
C27H34N4O5S
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Chemical Name:
N-(12,12-dimethyl-5-nonyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)-2-nitrobenzamide
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Synonyms:
MLS000587332;SMR000211350;N-(6,6-Dimethyl-2-nonyl-4-oxo-5,8-dihydro-4H,6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2-nitro-benzamide;N-(6,6-dimethyl-2-nonyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-yl)-2-nitrobenzamide;MLS003901898;CHEMBL1337018;BDBM55028;C27H34N4O5S;cid_1601813;HMS2589M22;KUC106442N;ZINC1822679;STK087910;AKOS005394039;KSC-12-248;MCULE-1412178906;303959-66-2;N-(4-keto-6,6-dimethyl-2-nonyl-5,8-dihydropyrano[2,3]thieno[2,4-d]pyrimidin-3-yl)-2-nitro-benzamide;N-(6,6-dimethyl-2-nonyl-4-oxidanylidene-5,8-dihydropyrano[2,3]thieno[2,4-d]pyrimidin-3-yl)-2-nitro-benzamide;N-(6,6-dimethyl-2-nonyl-4-oxo-5,8-dihydropyrano[2,3]thieno[2,4-d]pyrimidin-3-yl)-2-nitrobenzamide
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CAS No:
N-(12,12-dimethyl-5-nonyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)-2-nitrobenzamide Basic Attributes
526.6 g/mol
526.22499137 g/mol
Computed Properties
Molecular Weight:526.6
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:526.22499137
Monoisotopic Mass:526.22499137
Topological Polar Surface Area:145
Heavy Atom Count:37
Complexity:875
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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