Vitas-M small molecule compound
6-{3-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-oxopropyl}-3,5-dimethyl-7H-furo[3,2-g]chromen-7-one
Catalog ID
STK621376
SMILES O=C(N1CCC(CC1)c1nc2c([nH]1)cccc2)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C
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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 C28H27N3O4 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O4/c1-16-15-34-24-14-25-21(13-20(16)24)17(2)19(28(33)35-25)7-8-26(32)31-11-9-18(10-12-31)27-29-22-5-3-4-6-23(22)30-27/h3-6,13-15,18H,7-12H2,1-2H3,(H,29,30)InChIKey
LWDQAXFZUWWZKF-UHFFFAOYSA-NSynonyms
951965-59-66(3(4(1Hbenzimidazol2yl)piperidin1yl)3oxopropyl)35dimethyl7Hfuro(32g)chromen7one
6(3(4(1Hbenzimidazol2yl)piperidin1yl)3oxopropyl)35dimethylfuro(32g)chromen7one
6(3(4(1Hbenzo(d)imidazol2yl)piperidin1yl)3oxopropyl)35dimethyl7Hfuro(32g)chromen7one
951965596
CC1=COC2=CC3=C(C=C12)C(=C(C(=O)O3)CCC(=O)N4CCC(CC4)C5=NC6=CC=CC=C6N5)C
InChI=1SC28H27N3O4c116153424142521(1320(16)24)17(2)19(28(33)3525)7826(32)3111918(101231)272922534623(22)3027h36131518H712H212H3(H2930)
MFCD09857049
O=C(N1CCC(CC1)c1nc2c((nH)1)cccc2)CCc1c(=O)oc2c(c1C)cc1c(c2)occ1C
ZINC000013728802
ZINC13728802
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