Vitas-M small molecule compound

5-(5-chloro-1,3-benzoxazol-2-yl)-2-(tetrahydrofuran-2-ylmethyl)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK047786
SMILES Clc1ccc2c(c1)nc(o2)c1ccc2c(c1)C(=O)N(C2=O)CC1CCCO1

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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 C20H15ClN2O4 MW 382.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O4/c21-12-4-6-17-16(9-12)22-18(27-17)11-3-5-14-15(8-11)20(25)23(19(14)24)10-13-2-1-7-26-13/h3-6,8-9,13H,1-2,7,10H2
InChIKey
PNOIUYHJTDRHAI-UHFFFAOYSA-N
Synonyms

5(5CHLORO13BENZOXAZOL2YL)2((2S)TETRAHYDROFURAN2YLMETHYL)1HISOINDOLE13(2H)DIONE
5(5CHLORO13BENZOXAZOL2YL)2(OXOLAN2YLMETHYL)ISOINDOLE13DIONE
5(5CHLORO13BENZOXAZOL2YL)2(TETRAHYDROFURAN2YLMETHYL)1HISOINDOLE13(2H)DIONE
5(5chlorobenzo(d)oxazol2yl)2((tetrahydrofuran2yl)methyl)isoindoline13dione
C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(O4)C=CC(=C5)Cl
Clc1ccc2c(c1)nc(o2)c1ccc2c(c1)C(=O)N(C2=O)CC1CCCO1
InChI=1SC20H15ClN2O4c2112461716(912)2218(2717)11351415(811)20(25)23(19(14)24)10132172613h368913H12710H2
MFCD01974250
STK047786
ZINC000002305877
ZINC000002305878
ZINC02305877
ZINC02305878

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Available files

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