Vitas-M small molecule compound

10-(cyclopropylcarbonyl)-3,3-dimethyl-11-(2,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK263071
SMILES COc1cc(OC)c(cc1C1C2=C(Nc3c(N1C(=O)C1CC1)cccc3)CC(CC2=O)(C)C)OC

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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 C28H32N2O5 MW 476.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O5/c1-28(2)14-19-25(21(31)15-28)26(17-12-23(34-4)24(35-5)13-22(17)33-3)30(27(32)16-10-11-16)20-9-7-6-8-18(20)29-19/h6-9,12-13,16,26,29H,10-11,14-15H2,1-5H3
InChIKey
AJJBNEMSLBQOOG-UHFFFAOYSA-N
Synonyms
895362-31-9
10(cyclopropanecarbonyl)33dimethyl11(245trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10(cyclopropylcarbonyl)33dimethyl11(245trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10(CYCLOPROPYLCARBONYL)33DIMETHYL11(245TRIMETHOXYPHENYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
5(cyclopropanecarbonyl)99dimethyl6(245trimethoxyphenyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
895362319
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4CC4)C5=CC(=C(C=C5OC)OC)OC)C(=O)C1)C
InChI=1SC28H32N2O5c128(2)141925(21(31)1528)26(171223(344)24(355)1322(17)333)30(27(32)16101116)20976818(20)2919h691213162629H10111415H215H3
MFCD07642627
ZINC000009504964
ZINC000009504966

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Available files

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