537034-22-3
1-[2-[(2R)-4-[2-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ACETYL]-2-(3,4-DICHLOROPHENYL)-2-MORPHOLINYL]ETHYL]-ALPHA,ALPHA-DIMETHYL-4-PIPERIDINEACETAMIDE
Name
1-[2-[(2R)-4-[2-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ACETYL]-2-(3,4-DICHLOROPHENYL)-2-MORPHOLINYL]ETHYL]-ALPHA,ALPHA-DIMETHYL-4-PIPERIDINEACETAMIDE
Formula
C31 H35 Cl2 F6 N3 O3
MolWeight
682.529
1Identification
【Name】
1-[2-[(2R)-4-[2-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ACETYL]-2-(3,4-DICHLOROPHENYL)-2-MORPHOLINYL]ETHYL]-ALPHA,ALPHA-DIMETHYL-4-PIPERIDINEACETAMIDE
【CAS】
【MDL】
MFCD05260830
【English Synonyms】
【Formula】
C31 H35 Cl2 F6 N3 O3
【MolWeight】
682.529
【Inchi】
InChI=1S/C31H35Cl2F6N3O3/c1-28(2,27(40)44)20-5-8-41(9-6-20)10-7-29(21-3-4-24(32)25(33)17-21)18-42(11-12-45-29)26(43)15-19-13-22(30(34,35)36)16-23(14-19)31(37,38)39/h3-4,13-14,16-17,20H,5-12,15,18H2,1-2H3,(H2,40,44)/t29-/m0/s1
【InChIKey】
InChIKey=ZLNYUCXXSDDIFU-LJAQVGFWSA-N
【SMILES】
CC(C)(C1CCN(CC1)CC[C@]2(CN(CCO2)C(=O)Cc3cc(cc(c3)C(F)(F)F)C(F)(F)F)c4ccc(c(c4)Cl)Cl)C(=O)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:6.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[2-[(2R)-4-[2-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]ACETYL]-2-(3,4-DICHLOROPHENYL)-2-MORPHOLINYL]ETHYL]-ALPHA,ALPHA-DIMETHYL-4-PIPERIDINEACETAMIDE.cml
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