Vitas-M small molecule compound

11-(6-chloro-4-oxo-4H-chromen-3-yl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK055312
SMILES Clc1ccc2c(c1)c(=O)c(co2)C1Nc2cc(C)c(cc2NC2=C1C(=O)CC(C2)(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 C26H25ClN2O3 MW 448.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O3/c1-13-7-18-19(8-14(13)2)29-24(23-20(28-18)10-26(3,4)11-21(23)30)17-12-32-22-6-5-15(27)9-16(22)25(17)31/h5-9,12,24,28-29H,10-11H2,1-4H3
InChIKey
SAMOLXWGCCRQHP-UHFFFAOYSA-N
Synonyms
337491-90-4
11(6chloro4oxo4Hchromen3yl)3378tetramethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
337491904
6(6chloro4oxochromen3yl)2399tetramethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1=CC2=C(C=C1C)NC3=C(C(N2)C4=COC5=C(C4=O)C=C(C=C5)Cl)C(=O)CC(C3)(C)C
Clc1ccc2c(c1)c(=O)c(co2)C1Nc2cc(C)c(cc2NC2=C1C(=O)CC(C2)(C)C)C
InChI=1SC26H25ClN2O3c11371819(814(13)2)2924(2320(2818)1026(34)1121(23)30)171232226515(27)916(22)25(17)31h5912242829H1011H214H3
MFCD01655309
STK055312
ZINC000004047472
ZINC000004047478

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Available files

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