Vitas-M small molecule compound
(12bS)-2-(1-benzylpiperidin-4-yl)-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
STL528934
SMILES COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)C1CCN(CC1)Cc1ccccc1
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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 C37H42N4O4 MW 606.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H42N4O4/c1-24(2)45-31-15-14-26(20-32(31)44-4)29-22-41-33(42)23-40(27-16-18-39(19-17-27)21-25-10-6-5-7-11-25)36(43)37(41,3)35-34(29)28-12-8-9-13-30(28)38-35/h5-15,20,24,27,29,38H,16-19,21-23H2,1-4H3/t29?,37-/m0/s1InChIKey
OULZYOPFULMYCC-SUKJUDMCSA-NSynonyms
956819-03-7(12bS)2(1benzylpiperidin4yl)7(3methoxy4(propan2yloxy)phenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(1benzylpiperidin4yl)7(4isopropoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4(1benzylpiperidin4yl)9(3methoxy4propan2yloxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403821
956819037
COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)C1CCN(CC1)Cc1ccccc1
InChI=1SC37H42N4O4c124(2)4531151426(2032(31)444)29224133(42)2340(27161839(191727)2125106571125)36(43)37(413)3534(29)2812891330(28)3835h5152024272938H16192123H214H3t29?37m0s1
MFCD06765349
ZINC000070699475
ZINC000070699477
Check stock
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Check stock on Vitas-MAvailable files
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