Name: Danavorexton
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214323065
Cas No:2114324-48-8
常用名:Danavorexton
IUPAC:methyl (2R,3S)-3-methanesulfonamido-2-({[(1s,4s)-4-phenylcyclohexyl]oxy}methyl)piperidine-1-carboxylate
IUPAC:methyl (2R,3S)-3-methanesulfonamido-2-({[(1s,4s)-4-phenylcyclohexyl]oxy}methyl)piperidine-1-carboxylate
InChI key:UXZAJSZFFARTEI-YRPNKDGESA-N

分子式:C21H32N2O5S
分子量:424.56
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COC(=O)N1CCC[C@H](NS(C)(=O)=O)[C@@H]1CO[C@H]1CC[C@H](CC1)c1ccccc1 |wU:14.15,8.8,wD:17.17,20.24,(6.67,-.77,;5.33,,;4,-.77,;4,-2.31,;2.67,,;2.67,1.54,;1.33,2.31,;,1.54,;;-1.33,-.77,;-1.33,-2.31,;-1.33,-3.85,;-2.87,-2.31,;.21,-2.31,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;1.33,-5.39,;1.33,-6.93,;2.67,-7.7,;4,-6.93,;4,-5.39,;2.67,-9.24,;4,-10.01,;4,-11.55,;2.67,-12.32,;1.33,-11.55,;1.33,-10.01,)|
SMILES:COC(=O)N1CCC[C@H](NS(C)(=O)=O)[C@@H]1CO[C@H]1CC[C@H](CC1)c1ccccc1 |wU:14.15,8.8,wD:17.17,20.24,(6.67,-.77,;5.33,,;4,-.77,;4,-2.31,;2.67,,;2.67,1.54,;1.33,2.31,;,1.54,;;-1.33,-.77,;-1.33,-2.31,;-1.33,-3.85,;-2.87,-2.31,;.21,-2.31,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;2.67,-4.62,;1.33,-5.39,;1.33,-6.93,;2.67,-7.7,;4,-6.93,;4,-5.39,;2.67,-9.24,;4,-10.01,;4,-11.55,;2.67,-12.32,;1.33,-11.55,;1.33,-10.01,)|

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