Vitas-M small molecule compound
N~2~-{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}-N~2~-(2-fluorobenzyl)-2-methyl-N-tricyclo[3.3.1.1~3,7~]dec-1-ylalaninamide
Catalog ID
STL439355
SMILES O=C(N(C(C(=O)NC12CC3CC(C2)CC(C1)C3)(C)C)Cc1ccccc1F)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2
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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 C37H46FN3O2 MW 583.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H46FN3O2/c1-22-32(27-11-7-9-13-30(27)39-22)33-28(35(33,2)3)17-31(42)41(21-26-10-6-8-12-29(26)38)36(4,5)34(43)40-37-18-23-14-24(19-37)16-25(15-23)20-37/h6-13,23-25,28,33,39H,14-21H2,1-5H3,(H,40,43)InChIKey
BGNOGPZIIYVBPF-UHFFFAOYSA-NSynonyms
CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=CC=C4F)C(C)(C)C(=O)NC56CC7CC(C5)CC(C7)C6
InChI=1SC37H46FN3O2c12232(2711791330(27)3922)3328(35(332)3)1731(42)41(212610681229(26)38)36(45)34(43)403718231424(1937)1625(1523)2037h6132325283339H1421H215H3(H4043)
N(1ADAMANTYL)2((2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)((2FLUOROPHENYL)METHYL)AMINO)2METHYLPROPANAMIDE
N~2~((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)N~2~(2fluorobenzyl)2methylNtricyclo(3311~37~)dec1ylalaninamide
O=C(N(C(C(=O)NC12CC3CC(C2)CC(C1)C3)(C)C)Cc1ccccc1F)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2
ZINC000008749025
ZINC000106634849
Check stock
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Check stock on Vitas-MAvailable files
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