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CAS 1240526-24-2

:

1H-1,4-Diazepine-1-carboxylic acid, hexahydro-, phenyl ester, hydrochloride (1:1)

Description:
1H-1,4-Diazepine-1-carboxylic acid, hexahydro-, phenyl ester, hydrochloride (1:1) is a chemical compound characterized by its diazepine core, which consists of a seven-membered ring containing two nitrogen atoms. This compound features a carboxylic acid functional group and an ester linkage, contributing to its reactivity and potential applications in medicinal chemistry. The presence of the phenyl group enhances its lipophilicity, which may influence its biological activity and pharmacokinetics. As a hydrochloride salt, it is typically more soluble in water, facilitating its use in various formulations. The compound's structure suggests potential interactions with biological targets, making it of interest in drug development. Its CAS number, 1240526-24-2, allows for precise identification in chemical databases. Safety and handling precautions should be observed, as with all chemical substances, due to potential toxicity or reactivity. Further studies would be necessary to elucidate its specific properties, biological activities, and potential therapeutic applications.
Formula:C12H16N2O2·ClH
InChI:InChI=1S/C12H16N2O2.ClH/c15-12(14-9-4-7-13-8-10-14)16-11-5-2-1-3-6-11;/h1-3,5-6,13H,4,7-10H2;1H
InChI key:InChIKey=GIEBWDMAORMDPL-UHFFFAOYSA-N
SMILES:O(C(=O)N1CCCNCC1)C2=CC=CC=C2.Cl
Synonyms:
  • 1H-1,4-Diazepine-1-carboxylic acid, hexahydro-, phenyl ester, hydrochloride (1:1)
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