Vitas-M small molecule compound

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

Catalog ID
STL171512
SMILES CCCCCC(=O)N1C(c2ccc(cc2)OCCC)C2=C(Nc3c1cccc3)CC(CC2=O)(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 C30H38N2O3 MW 474.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H38N2O3/c1-5-7-8-13-27(34)32-25-12-10-9-11-23(25)31-24-19-30(3,4)20-26(33)28(24)29(32)21-14-16-22(17-15-21)35-18-6-2/h9-12,14-17,29,31H,5-8,13,18-20H2,1-4H3
InChIKey
TYQZQOOJDJNSSL-UHFFFAOYSA-N
Synonyms
438463-88-8
10hexanoyl33dimethyl11(4propoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
438463888
5hexanoyl99dimethyl6(4propoxyphenyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=C(C=C4)OCCC
InChI=1SC30H38N2O3c15781327(34)3225121091123(25)31241930(34)2026(33)28(24)29(32)21141622(171521)351862h91214172931H58131820H214H3
MFCD01921805
ZINC000013882098
ZINC000013882099

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Available files

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