Vitas-M small molecule compound
3-(azepan-1-yl)-5,10-bis(4-tert-butylphenoxy)anthra[1,9-cd:5,10-c'd']bis[1,2]oxazole
Catalog ID
STK683498
SMILES CC(c1ccc(cc1)Oc1ccc2c3c1c1onc4c1c(c3on2)c(Oc1ccc(cc1)C(C)(C)C)cc4N1CCCCCC1)(C)C
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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 C40H41N3O4 MW 627.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H41N3O4/c1-39(2,3)24-11-15-26(16-12-24)44-30-20-19-28-32-33(30)38-35-34(37(32)46-41-28)31(45-27-17-13-25(14-18-27)40(4,5)6)23-29(36(35)42-47-38)43-21-9-7-8-10-22-43/h11-20,23H,7-10,21-22H2,1-6H3InChIKey
USSIGFSWYUFYRW-UHFFFAOYSA-NSynonyms
3(AZEPAN1YL)510BIS(4TERTBUTYLPHENOXY)ANTHRA(19CD510CD)BIS(12)OXAZOLE
CC(C)(C)C1=CC=C(C=C1)OC2=C3C4=C(C5=C(C=C(C6=NOC3=C56)N7CCCCCC7)OC8=CC=C(C=C8)C(C)(C)C)ON=C4C=C2
InChI=1SC40H41N3O4c139(23)24111526(161224)44302019283233(30)383534(37(32)464128)31(4527171325(141827)40(45)6)2329(36(35)424738)4321978102243h112023H7102122H216H3
MFCD05257978
ZINC000098006110
ZINC98006110
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