2-[benzyl-(4,4-dimethyl-8-propan-2-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]ethanol
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![2-[benzyl-(4,4-dimethyl-8-propan-2-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]ethanol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0045e37c80a647bea25233b760140355.png "2-[benzyl-(4,4-dimethyl-8-propan-2-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]ethanol")
2-[benzyl-(4,4-dimethyl-8-propan-2-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]ethanol
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CAS No:
845631-92-7
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Formula:
C26H30N4O2S
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Chemical Name:
2-[benzyl-(4,4-dimethyl-8-propan-2-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]ethanol
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Synonyms:
ZINC2413641;STL304520;AKOS022100303;MCULE-1288950257;2-{benzyl[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amino}ethanol;845631-92-7
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CAS No:
2-[benzyl-(4,4-dimethyl-8-propan-2-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl)amino]ethanol Basic Attributes
462.6 g/mol
462.20894739 g/mol
Computed Properties
Molecular Weight:462.6
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:462.20894739
Monoisotopic Mass:462.20894739
Topological Polar Surface Area:99.6
Heavy Atom Count:33
Complexity:658
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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