Vitas-M small molecule compound
(12bS)-2-[2-(3-fluorophenyl)ethyl]-7-[3-methoxy-4-(propan-2-yloxy)phenyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529362
SMILES COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1cccc(c1)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 C33H34FN3O4 MW 555.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H34FN3O4/c1-20(2)41-27-13-12-22(17-28(27)40-4)25-18-37-29(38)19-36(15-14-21-8-7-9-23(34)16-21)32(39)33(37,3)31-30(25)24-10-5-6-11-26(24)35-31/h5-13,16-17,20,25,35H,14-15,18-19H2,1-4H3/t25?,33-/m0/s1InChIKey
NYDPLABTTUWXDM-ZEWJHAJUSA-NSynonyms
956826-47-4(12bS)2(2(3fluorophenyl)ethyl)7(3methoxy4(propan2yloxy)phenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(3fluorophenethyl)7(4isopropoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4(2(3fluorophenyl)ethyl)9(3methoxy4propan2yloxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404563
956826474
COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1cccc(c1)F
InChI=1SC33H34FN3O4c120(2)4127131222(1728(27)404)25183729(38)1936(15142187923(34)1621)32(39)33(373)3130(25)2410561126(24)3531h5131617202535H14151819H214H3t25?33m0s1
MFCD06767455
ZINC000070700759
ZINC000070700761
Check stock
See real-time availability and sample size for STL529362 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.