Vitas-M small molecule compound

methyl (8-chloro-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetate

Catalog ID
STL335912
SMILES COC(=O)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)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 C13H10ClN3O3 MW 291.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10ClN3O3/c1-20-10(18)5-17-6-15-11-8-4-7(14)2-3-9(8)16-12(11)13(17)19/h2-4,6,16H,5H2,1H3
InChIKey
ZDNNVTJDYNSADG-UHFFFAOYSA-N
Synonyms
500194-51-4
500194514
COC(=O)CN1C=NC2=C(C1=O)NC3=C2C=C(C=C3)Cl
COC(=O)Cn1cnc2c(c1=O)(nH)c1c2cc(cc1)Cl
InChI=1SC13H10ClN3O3c12010(18)51761511847(14)239(8)1612(11)13(17)19h24616H5H21H3
methyl(8chloro4oxo45dihydro3Hpyrimido(54b)indol3yl)acetate
methyl2(8chloro4oxo45dihydro3Hpyrimido(54b)indol3yl)acetate
METHYL2(8CHLORO4OXO5HPYRIMIDO(54B)INDOL3YL)ACETATE
MFCD03304781
ZINC000000552246
ZINC00552246
ZINC552246

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Available files

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