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N-[(7S)-1,2,3-trimethoxy-9-oxo-10-({(2S)-1-oxo-1-[4-(pyridin-2-yl)piperazin-1-yl]propan-2-yl}amino)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide

Catalog ID
STL541089
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)N2CCN(CC2)c2ccccn2)C)NC(=O)C)cc(c1OC)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 C33H39N5O6 MW 601.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N5O6/c1-20(33(41)38-16-14-37(15-17-38)29-8-6-7-13-34-29)35-26-12-10-23-24(19-27(26)40)25(36-21(2)39)11-9-22-18-28(42-3)31(43-4)32(44-5)30(22)23/h6-8,10,12-13,18-20,25H,9,11,14-17H2,1-5H3,(H,35,40)(H,36,39)/t20-,25-/m0/s1
InChIKey
APKQCXJJDUHTMM-CPJSRVTESA-N
Synonyms
1574355-62-6
~(N)((7~(S))123trimethoxy9oxo10(((2~(S))1oxo1(4pyridin2ylpiperazin1yl)propan2yl)amino)67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1574355626
75492153
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)N2CCN(CC2)c2ccccn2)C)NC(=O)C)cc(c1OC)OC
InChI=1SC33H39N5O6c120(33(41)38161437(151738)29867133429)352612102324(1927(26)40)25(3621(2)39)119221828(423)31(434)32(445)30(22)23h68101213182025H9111417H215H3(H3540)(H3639)t2025m0s1
N((7S)123trimethoxy9oxo10(((2S)1oxo1(4(pyridin2yl)piperazin1yl)propan2yl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
N((S)123trimethoxy9oxo10(((S)1oxo1(4(pyridin2yl)piperazin1yl)propan2yl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000108450381
ZINC108450381

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Available files

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