Vitas-M small molecule compound

N-(4,5,6,7-tetrahydro-2,1-benzoxazol-3-yl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide

Catalog ID
STK518389
SMILES O=C(C1COc2c(O1)cccc2)Nc1onc2c1CCCC2

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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 C16H16N2O4 MW 300.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4/c19-15(14-9-20-12-7-3-4-8-13(12)21-14)17-16-10-5-1-2-6-11(10)18-22-16/h3-4,7-8,14H,1-2,5-6,9H2,(H,17,19)
InChIKey
WJVKYRXOHPGZOV-UHFFFAOYSA-N
Synonyms
898611-30-8
898611308
C1CCC2=NOC(=C2C1)NC(=O)C3COC4=CC=CC=C4O3
InChI=1SC16H16N2O4c1915(1492012734813(12)2114)171610512611(10)182216h347814H12569H2(H1719)
MFCD08550081
N(4567tetrahydro21benzoxazol3yl)23dihydro14benzodioxine2carboxamide
N(4567tetrahydro21benzoxazol3yl)23dihydro14benzodioxine3carboxamide
ZINC000008976612
ZINC000008976613

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Available files

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