1-cyclohexyl-3-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]thiourea
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1-cyclohexyl-3-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]thiourea
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CAS No:
454193-11-4
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Formula:
C20H27N5S
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Chemical Name:
1-cyclohexyl-3-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]thiourea
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Synonyms:
Oprea1_163683;ZINC3285635;AKOS000960537;MCULE-8547429931;Z45774958;3-cyclohexyl-1-(4-{5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}phenyl)thiourea;454193-11-4
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CAS No:
1-cyclohexyl-3-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]thiourea Basic Attributes
369.5 g/mol
369.19871706 g/mol
Computed Properties
Molecular Weight:369.5
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:369.19871706
Monoisotopic Mass:369.19871706
Topological Polar Surface Area:86.9
Heavy Atom Count:26
Complexity:459
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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