Vitas-M small molecule compound

3-(4-fluorophenyl)-10-[(4-methoxyphenyl)carbonyl]-11-[4-(pentyloxy)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK039167
SMILES CCCCCOc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)F)Nc2c(N1C(=O)c1ccc(cc1)OC)cccc2

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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 C38H37FN2O4 MW 604.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H37FN2O4/c1-3-4-7-22-45-31-20-12-26(13-21-31)37-36-33(23-28(24-35(36)42)25-10-16-29(39)17-11-25)40-32-8-5-6-9-34(32)41(37)38(43)27-14-18-30(44-2)19-15-27/h5-6,8-21,28,37,40H,3-4,7,22-24H2,1-2H3
InChIKey
LAWAZZKJFXTFSY-UHFFFAOYSA-N
Synonyms
523992-96-3
3(4fluorophenyl)10((4methoxyphenyl)carbonyl)11(4(pentyloxy)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4FLUOROPHENYL)10((4METHOXYPHENYL)CARBONYL)11(4PENTYLOXYPHENYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
3(4fluorophenyl)10(4methoxybenzoyl)11(4(pentyloxy)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
523992963
9(4fluorophenyl)5(4methoxybenzoyl)6(4pentoxyphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)F)NC5=CC=CC=C5N2C(=O)C6=CC=C(C=C6)OC
CCCCCOc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)F)Nc2c(N1C(=O)c1ccc(cc1)OC)cccc2
InChI=1SC38H37FN2O4c1347224531201226(132131)373633(2328(2435(36)42)25101629(39)171125)4032856934(32)41(37)38(43)27141830(442)191527h56821283740H3472224H212H3
MFCD03488998
STK039167
ZINC000097948803
ZINC000097948806

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Available files

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