Vitas-M small molecule compound

1-(3-chlorophenyl)-3-[2-methyl-1-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)propan-2-yl]urea

Catalog ID
STK737003
SMILES O=C(NC(COC12CC3CC(C2)CC(C1)C3)(C)C)Nc1cccc(c1)Cl

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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 C21H29ClN2O2 MW 376.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29ClN2O2/c1-20(2,24-19(25)23-18-5-3-4-17(22)9-18)13-26-21-10-14-6-15(11-21)8-16(7-14)12-21/h3-5,9,14-16H,6-8,10-13H2,1-2H3,(H2,23,24,25)
InChIKey
REEBBIYDGYBCQB-UHFFFAOYSA-N
Synonyms

1(1(1ADAMANTYLOXY)2METHYLPROPAN2YL)3(3CHLOROPHENYL)UREA
1(3chlorophenyl)3(2methyl1(tricyclo(3311~37~)dec1yloxy)propan2yl)urea
CC(C)(COC12CC3CC(C1)CC(C3)C2)NC(=O)NC4=CC(=CC=C4)Cl
InChI=1SC21H29ClN2O2c120(22419(25)231853417(22)918)1326211014615(1121)816(714)1221h3591416H681013H212H3(H2232425)
MFCD05258065
ZINC000004687125
ZINC04687125
ZINC4687125

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.