Vitas-M small molecule compound
3-(8-fluoro-5H-pyrimido[5,4-b]indol-4-yl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL349838
SMILES Fc1ccc2c(c1)c1ncnc(c1[nH]2)N1CC2CC(C1)c1n(C2)c(=O)ccc1
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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 C21H18FN5O MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN5O/c22-14-4-5-16-15(7-14)19-20(25-16)21(24-11-23-19)26-8-12-6-13(10-26)17-2-1-3-18(28)27(17)9-12/h1-5,7,11-13,25H,6,8-10H2InChIKey
UHRBCIFXDYVFFG-UHFFFAOYSA-NSynonyms
(1R5S)3(8fluoro5Hpyrimido(54b)indol4yl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
3(8fluoro5Hpyrimido(54b)indol4yl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
C1C2CN(CC1C3=CC=CC(=O)N3C2)C4=NC=NC5=C4NC6=C5C=C(C=C6)F
Fc1ccc2c(c1)c1ncnc(c1(nH)2)N1C(C@H)2CC(C1)c1n(C2)c(=O)ccc1
Fc1ccc2c(c1)c1ncnc(c1(nH)2)N1CC2CC(C1)c1n(C2)c(=O)ccc1
InChI=1SC21H18FN5Oc2214451615(714)1920(2516)21(24112319)26812613(1026)1721318(28)27(17)912h157111325H6810H2
MFCD08288086
ZINC000101412054
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