Vitas-M small molecule compound
2-(1,3-benzoxazol-2-ylamino)-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Catalog ID
STK167371
SMILES COc1cc(ccc1OC)C1N=C(Nc2nc3c(o2)cccc3)NC2=C1C(=O)CC(C2)(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 C25H26N4O4 MW 446.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4/c1-25(2)12-16-21(17(30)13-25)22(14-9-10-19(31-3)20(11-14)32-4)28-23(26-16)29-24-27-15-7-5-6-8-18(15)33-24/h5-11,22H,12-13H2,1-4H3,(H2,26,27,28,29)InChIKey
NUSSVKJWMPGUTO-UHFFFAOYSA-NSynonyms
669718-72-32(13benzoxazol2ylamino)4(34dimethoxyphenyl)77dimethyl1468tetrahydroquinazolin5one
2(13benzoxazol2ylamino)4(34dimethoxyphenyl)77dimethyl4678tetrahydroquinazolin5(1H)one
2(benzo(d)oxazol2ylamino)4(34dimethoxyphenyl)77dimethyl4678tetrahydroquinazolin5(1H)one
669718723
CC1(CC2=C(C(N=C(N2)NC3=NC4=CC=CC=C4O3)C5=CC(=C(C=C5)OC)OC)C(=O)C1)C
InChI=1SC25H26N4O4c125(2)121621(17(30)1325)22(1491019(313)20(1114)324)2823(2616)29242715756818(15)3324h51122H1213H214H3(H226272829)
MFCD04176219
ZINC000009013274
ZINC000017014974
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