Vitas-M small molecule compound
2-(4-tert-butylphenyl)-3-(4-chloro-3-methylphenyl)-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK053162
SMILES O=C1N(c2ccc(c(c2)C)Cl)C(Nc2c1cccc2)c1ccc(cc1)C(C)(C)C
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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 C25H25ClN2O MW 404.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN2O/c1-16-15-19(13-14-21(16)26)28-23(17-9-11-18(12-10-17)25(2,3)4)27-22-8-6-5-7-20(22)24(28)29/h5-15,23,27H,1-4H3InChIKey
XDWXOBJXUSPRGK-UHFFFAOYSA-NSynonyms
2(4TERTBUTYLPHENYL)3(4CHLORO3METHYLPHENYL)12DIHYDROQUINAZOLIN4ONE
2(4TERTBUTYLPHENYL)3(4CHLORO3METHYLPHENYL)23DIHYDROQUINAZOLIN4(1H)ONE
CC1=C(C=CC(=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)C(C)(C)C)Cl
InChI=1SC25H25ClN2Oc1161519(131421(16)26)2823(1791118(121017)25(23)4)2722865720(22)24(28)29h5152327H14H3
MFCD02197526
O=C1N(c2ccc(c(c2)C)Cl)C(Nc2c1cccc2)c1ccc(cc1)C(C)(C)C
STK053162
ZINC000005739865
ZINC000005739868
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