Vitas-M small molecule compound

1-(3-bromophenyl)-3-(pyridin-3-ylmethyl)urea

Catalog ID
STL087666
SMILES O=C(Nc1cccc(c1)Br)NCc1cccnc1

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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 C13H12BrN3O MW 306.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12BrN3O/c14-11-4-1-5-12(7-11)17-13(18)16-9-10-3-2-6-15-8-10/h1-8H,9H2,(H2,16,17,18)
InChIKey
QICPPHIRJHKOGG-UHFFFAOYSA-N
Synonyms

1(3bromophenyl)3(pyridin3ylmethyl)urea
C1=CC(=CC(=C1)Br)NC(=O)NCC2=CN=CC=C2
InChI=1SC13H12BrN3Oc141141512(711)1713(18)1691032615810h18H9H2(H2161718)
MFCD00030898
ZINC000000398063
ZINC00398063
ZINC398063

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Available files

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