Vitas-M small molecule compound
8,10-di-tert-butyl-3-(4-fluorophenyl)-2-methyl-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Catalog ID
STL124874
SMILES Fc1ccc(cc1)N1C(=O)NC2CC1(C)Oc1c2cc(cc1C(C)(C)C)C(C)(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 C25H31FN2O2 MW 410.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31FN2O2/c1-23(2,3)15-12-18-20-14-25(7,30-21(18)19(13-15)24(4,5)6)28(22(29)27-20)17-10-8-16(26)9-11-17/h8-13,20H,14H2,1-7H3,(H,27,29)InChIKey
SCQKEWIXWWJVFQ-UHFFFAOYSA-NSynonyms
810ditertbutyl3(4fluorophenyl)2methyl2356tetrahydro4H26methano135benzoxadiazocin4one
CC12CC(C3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)NC(=O)N2C4=CC=C(C=C4)F
InChI=1SC25H31FN2O2c123(23)151218201425(73021(18)19(1315)24(45)6)28(22(29)2720)1710816(26)91117h81320H14H217H3(H2729)
MFCD20736228
ZINC000101755222
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