Vitas-M small molecule compound

methyl 1-{[3-(pentafluorophenoxy)phenyl]carbamoyl}-D-prolinate

Catalog ID
STK549218
SMILES COC(=O)[C@H]1CCCN1C(=O)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C19H15F5N2O4 MW 430.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15F5N2O4/c1-29-18(27)11-6-3-7-26(11)19(28)25-9-4-2-5-10(8-9)30-17-15(23)13(21)12(20)14(22)16(17)24/h2,4-5,8,11H,3,6-7H2,1H3,(H,25,28)/t11-/m1/s1
InChIKey
XJLNUZXMNKTPNZ-LLVKDONJSA-N
Synonyms
956963-97-6
(R)METHYL1((3(PERFLUOROPHENOXY)PHENYL)CARBAMOYL)PYRROLIDINE2CARBOXYLATE
956963976
COC(=O)(C@H)1CCCN1C(=O)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)F
COC(=O)C1CCCN1C(=O)NC2=CC(=CC=C2)OC3=C(C(=C(C(=C3F)F)F)F)F
InChI=1SC19H15F5N2O4c12918(27)1163726(11)19(28)25942510(89)301715(23)13(21)12(20)14(22)16(17)24h245811H367H21H3(H2528)t11m1s1
methyl(2R)1((3(23456pentafluorophenoxy)phenyl)carbamoyl)pyrrolidine2carboxylate
methyl1((3(pentafluorophenoxy)phenyl)carbamoyl)Dprolinate
MFCD03680422
ZINC000004326467
ZINC04326467
ZINC4326467

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.