Vitas-M small molecule compound
2-[(3,5-dichlorophenyl)amino]-4'-methyl-2'-(4-methylpiperazin-1-yl)-4,5'-bipyrimidin-6(1H)-one
Catalog ID
STK514135
SMILES CN1CCN(CC1)c1ncc(c(n1)C)c1nc(Nc2cc(Cl)cc(c2)Cl)[nH]c(=O)c1
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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 C20H21Cl2N7O MW 446.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N7O/c1-12-16(11-23-20(24-12)29-5-3-28(2)4-6-29)17-10-18(30)27-19(26-17)25-15-8-13(21)7-14(22)9-15/h7-11H,3-6H2,1-2H3,(H2,25,26,27,30)InChIKey
LDUNGULQGSCAPP-UHFFFAOYSA-NSynonyms
2((35dichlorophenyl)amino)4methyl2(4methylpiperazin1yl)45bipyrimidin6(1H)one
2(35dichloroanilino)6(4methyl2(4methylpiperazin1yl)pyrimidin5yl)1Hpyrimidin4one
CC1=NC(=NC=C1C2=CC(=O)N=C(N2)NC3=CC(=CC(=C3)Cl)Cl)N4CCN(CC4)C
CN1CCN(CC1)c1ncc(c(n1)C)c1nc(Nc2cc(Cl)cc(c2)Cl)(nH)c(=O)c1
InChI=1SC20H21Cl2N7Oc11216(112320(2412)295328(2)4629)171018(30)2719(2617)2515813(21)714(22)915h711H36H212H3(H225262730)
MFCD13370611
ZINC000036235668
ZINC36235668
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