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N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-2-[(2R,6'R)-7-chloro-4,6-dimethoxy-2'-(4-methoxyphenyl)-6'-methyl-3,4'-dioxo-6',7'-dihydro-3H,4'H-2,5'-spirobi[[1]benzofuran]-3'-yl]acetamide

Catalog ID
STL561710
SMILES COc1ccc(cc1)c1oc2c(c1CC(=O)N[C@H](c1nc3c([nH]1)cccc3)C(C)C)C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC

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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 C38H36ClN3O8 MW 698.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H36ClN3O8/c1-18(2)32(37-40-23-9-7-8-10-24(23)41-37)42-28(43)16-22-29-26(49-33(22)20-11-13-21(46-4)14-12-20)15-19(3)38(35(29)44)36(45)30-25(47-5)17-27(48-6)31(39)34(30)50-38/h7-14,17-19,32H,15-16H2,1-6H3,(H,40,41)(H,42,43)/t19-,32+,38+/m1/s1
InChIKey
MOEQOMAARJGJBR-RIYSRZIMSA-N
Synonyms

145705066
COc1ccc(cc1)c1oc2c(c1CC(=O)N(C@H)(c1nc3c((nH)1)cccc3)C(C)C)C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
InChI=1SC38H36ClN3O8c118(2)32(3740239781024(23)4137)4228(43)16222926(4933(22)20111321(464)141220)1519(3)38(35(29)44)36(45)3025(475)1727(486)31(39)34(30)5038h714171932H1516H216H3(H4041)(H4243)t1932+38+m1s1
MFCD32650775
N((1S)1(1Hbenzimidazol2yl)2methylpropyl)2((2R6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi((1)benzofuran)3yl)acetamide
N((1S)1(1Hbenzimidazol2yl)2methylpropyl)2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxospiro(1benzofuran2567dihydro1benzofuran)3yl)acetamide
N((S)1(1Hbenzo(d)imidazol2yl)2methylpropyl)2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi(benzofuran)3yl)acetamide
ZINC001848442870

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Available files

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