benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyriMido[4,5-d]azepine-7(6H)-carboxylate
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![benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyriMido[4,5-d]azepine-7(6H)-carboxylate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b2030882504b48eba283fdbac2985131.png "benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyriMido[4,5-d]azepine-7(6H)-carboxylate")
benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyriMido[4,5-d]azepine-7(6H)-carboxylate
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CAS No:
1065113-62-3
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Formula:
C23H22ClN3O2
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Chemical Name:
benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyriMido[4,5-d]azepine-7(6H)-carboxylate
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Synonyms:
benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyrimido[4,5-d]azepine-7(6H)-carboxylate;1065113-62-3;SCHEMBL1623304;ZINC79016963;Benzyl 2-benzyl-4-chloro-5,6,8,9-tetrahydro-7H-pyrimido[4,5-d]azepine-7-carboxylate;benzyl 2-benzyl-4-chloro-5,6,8,9-tetrahydropyrimido[4,5-d]azepine-7-carboxylate
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CAS No:
benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyriMido[4,5-d]azepine-7(6H)-carboxylate Basic Attributes
408
407.14
Computed Properties
Molecular Weight:407.9
XLogP3:4.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:407.1400546
Monoisotopic Mass:407.1400546
Topological Polar Surface Area:55.3
Heavy Atom Count:29
Complexity:522
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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benzyl 2-benzyl-4-chloro-8,9-dihydro-5H-pyriMido[4,5-d]azepine-7(6H)-carboxylate
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