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CAS 917022-13-0

:

tert-butyl N-[[4-[[(4-amino-6-chloro-pyrimidin-2-yl)amino]methyl]cyclohexyl]methyl]-N-[3-[tert-butoxycarbonyl(cyclohexyl)amino]propyl]carbamate

Description:
Tert-butyl N-[[4-[[(4-amino-6-chloro-pyrimidin-2-yl)amino]methyl]cyclohexyl]methyl]-N-[3-[tert-butoxycarbonyl(cyclohexyl)amino]propyl]carbamate, with CAS number 917022-13-0, is a complex organic compound characterized by its multi-functional structure. It features a tert-butyl group, which contributes to its hydrophobic properties, and a carbamate functional group that can participate in hydrogen bonding and may influence its solubility and reactivity. The presence of a pyrimidine ring, specifically substituted with an amino group and a chlorine atom, suggests potential biological activity, possibly as a pharmaceutical agent. The cyclohexyl moieties enhance steric bulk, which can affect the compound's interaction with biological targets. This compound is likely to be solid at room temperature and may exhibit moderate to high stability under standard conditions. Its synthesis and application may be relevant in medicinal chemistry, particularly in the development of targeted therapies. However, detailed studies on its pharmacokinetics, toxicity, and specific applications would be necessary to fully understand its characteristics and potential uses.
Formula:C31H53ClN6O4
InChI:InChI=1/C31H53ClN6O4/c1-30(2,3)41-28(39)37(17-10-18-38(24-11-8-7-9-12-24)29(40)42-31(4,5)6)21-23-15-13-22(14-16-23)20-34-27-35-25(32)19-26(33)36-27/h19,22-24H,7-18,20-21H2,1-6H3,(H3,33,34,35,36)/t22-,23-
SMILES:CC(C)(C)OC(=O)N(CCCN(C1CCCCC1)C(=O)OC(C)(C)C)C[C@H]1CC[C@@H](CC1)CN=c1[nH]c(cc(=N)[nH]1)Cl
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