Tert-butyl 1,4-dibenzyl-1,4-diazepane-5-carboxylate

Base Information

• Chemical Name: Tert-butyl 1,4-dibenzyl-1,4-diazepane-5-carboxylate
• CAS No.: 138883-21-3
• Molecular Formula: C₂₄H₃₂N₂O₂
• Molecular Weight: 380.53
• DSSTox Substance ID: DTXSID801135153

Synonyms:SCHEMBL343508;tert-butyl 1,4-dibenzyl-1,4-diazepane-5-carboxylate;XUZFRYUAABTBNZ-UHFFFAOYSA-N;DTXSID801135153;138883-21-3;1,1-Dimethylethyl hexahydro-1,4-bis(phenylmethyl)-1H-1,4-diazepine-5-carboxylate

Chemical Property of Tert-butyl 1,4-dibenzyl-1,4-diazepane-5-carboxylate

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 380.246378268
• Heavy Atom Count: 28
• Complexity: 476

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)C1CCN(CCN1CC2=CC=CC=C2)CC3=CC=CC=C3

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