2-[(14-methylsulfanyl-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]ethanol
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![2-[(14-methylsulfanyl-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]ethanol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/7e3b80a79e584c1f8c083fa01b3eb7a3.png "2-[(14-methylsulfanyl-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]ethanol")
2-[(14-methylsulfanyl-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]ethanol
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CAS No:
845636-21-7
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Formula:
C18H21N3OS3
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Chemical Name:
2-[(14-methylsulfanyl-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]ethanol
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Synonyms:
C18H21N3OS3;ZINC2413919;STL304331;AKOS022120970;MCULE-4223622321;2-{[9-(methylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}ethanol;845636-21-7
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CAS No:
2-[(14-methylsulfanyl-7-propan-2-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]ethanol Basic Attributes
391.6 g/mol
391.08467582 g/mol
Computed Properties
Molecular Weight:391.6
XLogP3:4.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:391.08467582
Monoisotopic Mass:391.08467582
Topological Polar Surface Area:138
Heavy Atom Count:25
Complexity:469
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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