Vitas-M small molecule compound

N~2~-(1,3-benzodioxol-5-ylmethyl)-N~4~-(4-chloro-2-methylphenyl)pteridine-2,4-diamine

Catalog ID
STK944081
SMILES Clc1ccc(c(c1)C)Nc1nc(NCc2ccc3c(c2)OCO3)nc2c1nccn2

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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 C21H17ClN6O2 MW 420.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN6O2/c1-12-8-14(22)3-4-15(12)26-20-18-19(24-7-6-23-18)27-21(28-20)25-10-13-2-5-16-17(9-13)30-11-29-16/h2-9H,10-11H2,1H3,(H2,24,25,26,27,28)
InChIKey
KDUGVFXCDFCGIS-UHFFFAOYSA-N
Synonyms
946298-37-9
(2((2HBENZO(34D)13DIOXOLEN5YLMETHYL)AMINO)PTERIDIN4YL)(4CHLORO2METHYLPHENYL)AMINE
2N(13benzodioxol5ylmethyl)4N(4chloro2methylphenyl)pteridine24diamine
946298379
CC1=C(C=CC(=C1)Cl)NC2=NC(=NC3=NC=CN=C32)NCC4=CC5=C(C=C4)OCO5
InChI=1SC21H17ClN6O2c112814(22)3415(12)26201819(24762318)2721(2820)251013251617(913)30112916h29H1011H21H3(H22425262728)
MFCD09974725
N~2~(13benzodioxol5ylmethyl)N~4~(4chloro2methylphenyl)pteridine24diamine
N2(13BENZODIOXOL5YLMETHYL)N4(4CHLORO2METHYLPHENYL)PTERIDINE24DIAMINE
N2(BENZO(D)(13)DIOXOL5YLMETHYL)N4(4CHLORO2METHYLPHENYL)PTERIDINE24DIAMINE
ZINC000013010892
ZINC13010892

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Available files

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