CAS 1251009-39-8

1,1-Dimethylethyl 1-(aminomethyl)-5,6,8,9-tetrahydro-7H-imidazo[1,5-d][1,4]diazepine-7-carboxylate

Description:

1,1-Dimethylethyl 1-(aminomethyl)-5,6,8,9-tetrahydro-7H-imidazo[1,5-d][1,4]diazepine-7-carboxylate, with CAS number 1251009-39-8, is a chemical compound characterized by its complex bicyclic structure, which includes an imidazo[1,5-d][1,4]diazepine core. This compound features a carboxylate functional group, contributing to its potential as a bioactive molecule. The presence of the dimethyl group indicates steric hindrance, which may influence its reactivity and interaction with biological targets. The aminomethyl substituent suggests potential for hydrogen bonding, enhancing solubility and reactivity in biological systems. Such structural features may impart pharmacological properties, making it of interest in medicinal chemistry. The compound's stability, solubility, and reactivity can be influenced by its molecular structure, which may also affect its biological activity and therapeutic potential. Further studies would be necessary to elucidate its specific applications and mechanisms of action in biological contexts.

Formula: C₁₃H₂₂N₄O₂

InChI: InChI=1S/C13H22N4O2/c1-13(2,3)19-12(18)16-5-4-11-10(8-14)15-9-17(11)7-6-16/h9H,4-8,14H2,1-3H3

InChI key: InChIKey=XRGOZJKFJFKMCT-UHFFFAOYSA-N

SMILES: C(N)C1=C2N(CCN(C(OC(C)(C)C)=O)CC2)C=N1

Synonyms:

• 7H-Imidazo[1,5-d][1,4]diazepine-7-carboxylic acid, 1-(aminomethyl)-5,6,8,9-tetrahydro-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 1-(aminomethyl)-5,6,8,9-tetrahydro-7H-imidazo[1,5-d][1,4]diazepine-7-carboxylate