3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
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![3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5f13df8cf849441c956e8f80e454791d.png "3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea")
3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
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CAS No:
722483-72-9
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Formula:
C22H24ClN5O2
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Chemical Name:
3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
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Synonyms:
CHEMBL1551646;HMS1897B07;ZINC3254050;STL268161;AKOS001049138;MCULE-2418946692;NCGC00134091-01;3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea;SR-01000913761;SR-01000913761-1;G786-0677;F2559-0044;3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-((6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)methyl)urea;722483-72-9;N'-(3-chlorophenyl)-N-(3-methoxyphenyl)-N-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea
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CAS No:
3-(3-chlorophenyl)-1-(3-methoxyphenyl)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea Basic Attributes
425.9 g/mol
425.1618527 g/mol
Computed Properties
Molecular Weight:425.9
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:425.1618527
Monoisotopic Mass:425.1618527
Topological Polar Surface Area:72.3
Heavy Atom Count:30
Complexity:568
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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