Vitas-M small molecule compound

N-[(1-oxophthalazin-2(1H)-yl)acetyl]-beta-alanine

Catalog ID
STL154668
SMILES O=C(Cn1ncc2c(c1=O)cccc2)NCCC(=O)O

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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 C13H13N3O4 MW 275.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O4/c17-11(14-6-5-12(18)19)8-16-13(20)10-4-2-1-3-9(10)7-15-16/h1-4,7H,5-6,8H2,(H,14,17)(H,18,19)
InChIKey
MDTOBHRDCXJGJR-UHFFFAOYSA-N
Synonyms
1246064-50-5
1246064505
3((2(1oxophthalazin2yl)acetyl)amino)propanoicacid
3(2(1oxophthalazin2(1H)yl)acetamido)propanoicacid
C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NCCC(=O)O
InChI=1SC13H13N3O4c1711(146512(18)19)81613(20)1042139(10)71516h147H568H2(H1417)(H1819)
MFCD18068904
N((1oxophthalazin2(1H)yl)acetyl)betaalanine
ZINC000049548894
ZINC49548894

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Available files

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