Vitas-M small molecule compound
3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-7,8-dimethoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL135196
SMILES COc1cc2c(cc1OC)[nH]c1c2ncn(c1=O)CC(=O)N1CCN(CC1)Cc1ccccc1
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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 C25H27N5O4 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O4/c1-33-20-12-18-19(13-21(20)34-2)27-24-23(18)26-16-30(25(24)32)15-22(31)29-10-8-28(9-11-29)14-17-6-4-3-5-7-17/h3-7,12-13,16,27H,8-11,14-15H2,1-2H3InChIKey
FLOYDOYJJFZUIF-UHFFFAOYSA-NSynonyms
3(2(4benzylpiperazin1yl)2oxoethyl)78dimethoxy35dihydro4Hpyrimido(54b)indol4one
3(2(4benzylpiperazin1yl)2oxoethyl)78dimethoxy5Hpyrimido(54b)indol4one
COC1=C(C=C2C(=C1)C3=C(N2)C(=O)N(C=N3)CC(=O)N4CCN(CC4)CC5=CC=CC=C5)OC
COc1cc2c(cc1OC)(nH)c1c2ncn(c1=O)CC(=O)N1CCN(CC1)Cc1ccccc1
InChI=1SC25H27N5O4c13320121819(1321(20)342)272423(18)261630(25(24)32)1522(31)2910828(91129)14176435717h3712131627H8111415H212H3
MFCD20754180
ZINC000035423709
ZINC35423709
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