Vitas-M small molecule compound
3-(4-fluorophenyl)-10-hexanoyl-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK143058
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)c1ccc(cc1)F
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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 C31H30FN3O4 MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30FN3O4/c1-2-3-4-12-29(37)34-27-11-6-5-10-25(27)33-26-18-22(20-13-15-23(32)16-14-20)19-28(36)30(26)31(34)21-8-7-9-24(17-21)35(38)39/h5-11,13-17,22,31,33H,2-4,12,18-19H2,1H3InChIKey
QPJFBALCNWJORW-UHFFFAOYSA-NSynonyms
3(4fluorophenyl)10hexanoyl11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4fluorophenyl)5hexanoyl6(3nitrophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)F)NC4=CC=CC=C41)C5=CC(=CC=C5)(N+)(=O)(O)
CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CC(C2)c1ccc(cc1)F
InChI=1SC31H30FN3O4c12341229(37)342711651025(27)33261822(20131523(32)161420)1928(36)30(26)31(34)2187924(1721)35(38)39h5111317223133H24121819H21H3
MFCD02375502
ZINC000018250756
ZINC000018250761
Check stock
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