1402797-58-3
(4S,5R)-5-(3,5-bis(trifluoromethyl)phenyl)-3-((2-(2-methoxy-5-(4-(trifluoromethyl)thiazol-2-ylamino)phenyl)-5,5-dimethylcyclohex-1-enyl)methyl)-4-methyloxazolidin-2-one
Name(4S,5R)-5-(3,5-bis(trifluoromethyl)phenyl)-3-((2-(2-methoxy-5-(4-(trifluoromethyl)thiazol-2-ylamino)phenyl)-5,5-dimethylcyclohex-1-enyl)methyl)-4-methyloxazolidin-2-one
1Identification
【Name】
(4S,5R)-5-(3,5-bis(trifluoromethyl)phenyl)-3-((2-(2-methoxy-5-(4-(trifluoromethyl)thiazol-2-ylamino)phenyl)-5,5-dimethylcyclohex-1-enyl)methyl)-4-methyloxazolidin-2-one
【CAS】
【MDL】
【English Synonyms】
【Formula】
C32H30F9N3O3S
【MolWeight】
707.65
【Inchi】
InChI=1S/C32H30F9N3O3S/c1-16-26(17-9-19(30(33,34)35)11-20(10-17)31(36,37)38)47-28(45)44(16)14-18-13-29(2,3)8-7-22(18)23-12-21(5-6-24(23)46-4)42-27-43-25(15-48-27)32(39,40)41/h5-6,9-12,15-16,26H,7-8,13-14H2,1-4H3,(H,42,43)/t16-,26-/m0/s1
【InChIKey】
InChIKey=AZFCEFPQKRJQNP-QMTYFTJSSA-N
【SMILES】
FC(C=1C=C(C=C(C1)C(F)(F)F)[C@@H]1[C@@H](N(C(O1)=O)CC1=C(CCC(C1)(C)C)C1=C(C=CC(=C1)NC=1SC=C(N1)C(F)(F)F)OC)C)(F)F
【MOL File】
(4S,5R)-5-(3,5-bis(t….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
(4S,5R)-5-(3,5-bis(trifluoromethyl)phenyl)-3-((2-(2-methoxy-5-(4-(trifluoromethyl)thiazol-2-ylamino)phenyl)-5,5-dimethylcyclohex-1-enyl)methyl)-4-methyloxazolidin-2-one.cml