957

N-[(1S,2R)-1-(3,5-difluorobenzyl)-3-({1-[4-(2,2-dimethylpropyl)thiophen-2-yl]cyclopropyl}amino)-2-hydroxypropyl]acetamide


Toggle HydrogenToggle Labels

Chemical Component Summary

NameN-[(1S,2R)-1-(3,5-difluorobenzyl)-3-({1-[4-(2,2-dimethylpropyl)thiophen-2-yl]cyclopropyl}amino)-2-hydroxypropyl]acetamide
IdentifiersN-[(2S,3R)-1-(3,5-difluorophenyl)-4-[[1-[4-(2,2-dimethylpropyl)thiophen-2-yl]cyclopropyl]amino]-3-hydroxy-butan-2-yl]ethanamide
FormulaC24 H32 F2 N2 O2 S
Molecular Weight450.585
TypeNON-POLYMER
Isomeric SMILESCC(=O)N[C@@H](Cc1cc(cc(c1)F)F)[C@@H](CNC2(CC2)c3cc(cs3)CC(C)(C)C)O
InChIInChI=1S/C24H32F2N2O2S/c1-15(29)28-20(9-16-7-18(25)11-19(26)8-16)21(30)13-27-24(5-6-24)22-10-17(14-31-22)12-23(2,3)4/h7-8,10-11,14,20-21,27,30H,5-6,9,12-13H2,1-4H3,(H,28,29)/t20-,21+/m0/s1
InChIKeyYEGCCSKZPHGALE-LEWJYISDSA-N

Chemical Details

Formal Charge0
Atom Count63
Chiral Atom Count2
Bond Count65
Aromatic Bond Count11

Related Resource References

Resource NameReference
Pharos CHEMBL1230648
PubChem 46891887
ChEMBL CHEMBL1230648