Vitas-M small molecule compound
1-(3-chloro-4-methoxyphenyl)-6-cyclopentyl-2-hydroxy-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Catalog ID
STK942423
SMILES COc1ccc(cc1Cl)n1c(O)nc(=O)c2c1NCN(C2)C1CCCC1
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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 C18H21ClN4O3 MW 376.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN4O3/c1-26-15-7-6-12(8-14(15)19)23-16-13(17(24)21-18(23)25)9-22(10-20-16)11-4-2-3-5-11/h6-8,11,20H,2-5,9-10H2,1H3,(H,21,24,25)InChIKey
JLHHZBASOJIRDS-UHFFFAOYSA-NSynonyms
1219564-66-51(3chloro4methoxyphenyl)6cyclopentyl2hydroxy5678tetrahydropyrimido(45d)pyrimidin4(1H)one
1(3chloro4methoxyphenyl)6cyclopentyl78dihydro5Hpyrimido(45d)pyrimidine24dione
1219564665
COC1=C(C=C(C=C1)N2C3=C(CN(CN3)C4CCCC4)C(=O)NC2=O)Cl
InChI=1SC18H21ClN4O3c126157612(814(15)19)231613(17(24)2118(23)25)922(102016)11423511h681120H25910H21H3(H212425)
MFCD18180083
ZINC000040288404
ZINC40288404
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