Vitas-M small molecule compound
4-(azepan-1-yl)-N-{4-[chloro(difluoro)methoxy]phenyl}-6-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]-1,3,5-triazin-2-amine
Catalog ID
STK678900
SMILES FC(Oc1ccc(cc1)Nc1nc(nc(n1)N1CCCCCC1)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3)(Cl)F
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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 C30H40ClF2N7O MW 588.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H40ClF2N7O/c31-30(32,33)41-25-7-5-24(6-8-25)34-26-35-27(38-9-3-1-2-4-10-38)37-28(36-26)39-11-13-40(14-12-39)29-18-21-15-22(19-29)17-23(16-21)20-29/h5-8,21-23H,1-4,9-20H2,(H,34,35,36,37)InChIKey
VGVSDELDMKEKSF-UHFFFAOYSA-NSynonyms
(6(4ADAMANTANYLPIPERAZINYL)4AZAPERHYDROEPINYL(135TRIAZIN2YL))(4(CHLORODIFLUOROMETHOXY)PHENYL)AMINE
4(4(1ADAMANTYL)PIPERAZIN1YL)6(AZEPAN1YL)N(4(CHLORO(DIFLUORO)METHOXY)PHENYL)135TRIAZIN2AMINE
4(azepan1yl)N(4(chloro(difluoro)methoxy)phenyl)6(4(tricyclo(3311~37~)dec1yl)piperazin1yl)135triazin2amine
C1CCCN(CC1)C2=NC(=NC(=N2)NC3=CC=C(C=C3)OC(F)(F)Cl)N4CCN(CC4)C56CC7CC(C5)CC(C7)C6
InChI=1SC30H40ClF2N7Oc3130(3233)41257524(6825)34263527(38931241038)3728(3626)39111340(141239)2918211522(1929)1723(1621)2029h582123H14920H2(H34353637)
MFCD03308394
ZINC000098005055
ZINC98005055
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