Vitas-M small molecule compound
11-(2-fluorophenyl)-3,3-dimethyl-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL482238
SMILES CCCCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1F)C(=O)CC(C2)(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 C26H29FN2O2 MW 420.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29FN2O2/c1-4-5-14-23(31)29-21-13-9-8-12-19(21)28-20-15-26(2,3)16-22(30)24(20)25(29)17-10-6-7-11-18(17)27/h6-13,25,28H,4-5,14-16H2,1-3H3InChIKey
BMOGBOQCBNGHBO-UHFFFAOYSA-NSynonyms
11(2fluorophenyl)33dimethyl10pentanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(2fluorophenyl)99dimethyl5pentanoyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=CC=C4F
InChI=1SC26H29FN2O2c1451423(31)292113981219(21)28201526(23)1622(30)24(20)25(29)1710671118(17)27h6132528H451416H213H3
MFCD01466121
ZINC000004477832
ZINC000004477833
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