1-Piperazinecarboxylic acid, 4-[3-fluoro-10,11-dihydro-8-(1-methylethyl)dibenzo[b,f]thiepin-10-yl]-, ethyl ester

Base Information

• Chemical Name: 1-Piperazinecarboxylic acid, 4-[3-fluoro-10,11-dihydro-8-(1-methylethyl)dibenzo[b,f]thiepin-10-yl]-, ethyl ester
• CAS No.: 70932-10-4
• Molecular Formula: C₂₄H₂₉FN₂O₂S
• Molecular Weight: 428.571
• DSSTox Substance ID: DTXSID501107652

Synonyms:SCHEMBL11334353;DTXSID501107652;1-Piperazinecarboxylic acid, 4-[3-fluoro-10,11-dihydro-8-(1-methylethyl)dibenzo[b,f]thiepin-10-yl]-, ethyl ester;70932-10-4

Chemical Property of 1-Piperazinecarboxylic acid, 4-[3-fluoro-10,11-dihydro-8-(1-methylethyl)dibenzo[b,f]thiepin-10-yl]-, ethyl ester

Chemical Property:

• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 428.19337751
• Heavy Atom Count: 30
• Complexity: 584

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• Canonical SMILES: CCOC(=O)N1CCN(CC1)C2CC3=C(C=C(C=C3)F)SC4=C2C=C(C=C4)C(C)C

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