Vitas-M small molecule compound
3-(3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocin-1(6aH)-ylcarbonyl)-6,8-difluoro-1-methylquinolin-4(1H)-one
Catalog ID
STL511724
SMILES Fc1cc(F)c2c(c1)c(=O)c(cn2C)C(=O)N1CCCC2=CC3CC(C12)CN1CCCCC31
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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 C26H29F2N3O2 MW 453.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29F2N3O2/c1-29-14-20(25(32)19-11-18(27)12-21(28)24(19)29)26(33)31-8-4-5-15-9-16-10-17(23(15)31)13-30-7-3-2-6-22(16)30/h9,11-12,14,16-17,22-23H,2-8,10,13H2,1H3InChIKey
GIKWXEOCKVNMHQ-UHFFFAOYSA-NSynonyms
135638064
3((6R13R)23466a78910121313adodecahydro1H613methanodipyrido(12a32e)azocine1carbonyl)68difluoro1methylquinolin4(1H)one
3(315diazatetracyclo(7710^(27)0^(1015))heptadec7ene3carbonyl)68difluoro1methylquinolin4one
3(34678910121313adecahydro2H613methanodipyrido(12a32e)azocin1(6aH)ylcarbonyl)68difluoro1methylquinolin4(1H)one
Fc1cc(F)c2c(c1)c(=O)c(cn2C)C(=O)N1CCCC2=C(C@H)3C(C@H)(C12)CN1CCCCC31
InChI=1SC26H29F2N3O2c1291420(25(32)191118(27)1221(28)24(19)29)26(33)31845159161017(23(15)31)1330732622(16)30h911121416172223H281013H21H3
MFCD31751800
ZINC000604404627
ZINC000604404630
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