Vitas-M small molecule compound
N-[(2S)-1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Catalog ID
STL226529
SMILES O=C(C1COc2c(O1)cccc2)N[C@H](C(=O)N1CCN(CC1)Cc1ccccc1)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 C23H27N3O4 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4/c1-17(24-22(27)21-16-29-19-9-5-6-10-20(19)30-21)23(28)26-13-11-25(12-14-26)15-18-7-3-2-4-8-18/h2-10,17,21H,11-16H2,1H3,(H,24,27)/t17-,21?/m0/s1InChIKey
RVMUKSKGGZWKAY-PBVYKCSPSA-NSynonyms
1014409-10-91014409109
CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)NC(=O)C3COC4=CC=CC=C4O3
InChI=1SC23H27N3O4c117(2422(27)211629199561020(19)3021)23(28)26131125(121426)15187324818h2101721H1116H21H3(H2427)t1721?m0s1
MFCD10488963
N((2S)1(4benzylpiperazin1yl)1oxopropan2yl)23dihydro14benzodioxine2carboxamide
N((2S)1(4benzylpiperazin1yl)1oxopropan2yl)23dihydro14benzodioxine3carboxamide
N((S)1(4benzylpiperazin1yl)1oxopropan2yl)23dihydrobenzo(b)(14)dioxine2carboxamide
O=C(C1COc2c(O1)cccc2)N(C@H)(C(=O)N1CCN(CC1)Cc1ccccc1)C
ZINC000013691087
ZINC000013691088
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