Vitas-M small molecule compound
3-(4-chlorophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-D-alaninate
Catalog ID
STK524990
SMILES O=C(N[C@@H](C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C(F)(F)F)C)OCc1ccccc1
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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 C27H19ClF3NO7 MW 561.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19ClF3NO7/c1-15(32-26(35)36-14-16-5-3-2-4-6-16)25(34)38-19-11-12-20-21(13-19)39-24(27(29,30)31)23(22(20)33)37-18-9-7-17(28)8-10-18/h2-13,15H,14H2,1H3,(H,32,35)/t15-/m1/s1InChIKey
VCEKEISEPJIJPT-OAHLLOKOSA-NSynonyms
(3(4CHLOROPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)(2R)2(PHENYLMETHOXYCARBONYLAMINO)PROPANOATE
(R)3(4chlorophenoxy)4oxo2(trifluoromethyl)4Hchromen7yl2(((benzyloxy)carbonyl)amino)propanoate
3(4chlorophenoxy)4oxo2(trifluoromethyl)4Hchromen7ylN((benzyloxy)carbonyl)Dalaninate
CC(C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=C(C=C3)Cl)NC(=O)OCC4=CC=CC=C4
InChI=1SC27H19ClF3NO7c115(3226(35)3614165324616)25(34)381911122021(1319)3924(27(2930)31)23(22(20)33)37189717(28)81018h21315H14H21H3(H3235)t15m1s1
MFCD18241537
O=C(N(C@@H)(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C(F)(F)F)C)OCc1ccccc1
ZINC000001737321
ZINC01737321
ZINC1737321
Check stock
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Check stock on Vitas-MAvailable files
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