Vitas-M small molecule compound

2-(benzylamino)-4-methylpyrimidine-5-carboxylic acid

Catalog ID
STK508789
SMILES OC(=O)c1cnc(nc1C)NCc1ccccc1

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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 C13H13N3O2 MW 243.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O2/c1-9-11(12(17)18)8-15-13(16-9)14-7-10-5-3-2-4-6-10/h2-6,8H,7H2,1H3,(H,17,18)(H,14,15,16)
InChIKey
ABLBDYTXAHBWRH-UHFFFAOYSA-N
Synonyms
857410-55-0
2(benzylamino)4methylpyrimidine5carboxylicacid
2BENZYLAMINO4METHYLPYRIMIDINE5CARBOXYLICACID
4METHYL2(BENZYLAMINO)PYRIMIDINE5CARBOXYLICACID
857410550
CC1=NC(=NC=C1C(=O)O)NCC2=CC=CC=C2
InChI=1SC13H13N3O2c1911(12(17)18)81513(169)147105324610h268H7H21H3(H1718)(H141516)
MFCD09439072
ZINC000012243738
ZINC12243738

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Available files

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