Vitas-M small molecule compound

N-{(2S)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-1-oxopropan-2-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide

Catalog ID
STK642885
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)[C@@H](NC(=O)C1COc2c(O1)cccc2)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 C23H27N3O5 MW 425.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O5/c1-16(24-22(27)21-15-30-19-5-3-4-6-20(19)31-21)23(28)26-13-11-25(12-14-26)17-7-9-18(29-2)10-8-17/h3-10,16,21H,11-15H2,1-2H3,(H,24,27)/t16-,21?/m0/s1
InChIKey
YGHQEXPHIWCODQ-BJQOMGFOSA-N
Synonyms
1214631-95-4
1214631954
CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)NC(=O)C3COC4=CC=CC=C4O3
COc1ccc(cc1)N1CCN(CC1)C(=O)(C@@H)(NC(=O)C1COc2c(O1)cccc2)C
InChI=1SC23H27N3O5c116(2422(27)21153019534620(19)3121)23(28)26131125(121426)177918(292)10817h3101621H1115H212H3(H2427)t1621?m0s1
MFCD18163120
N((2S)1(4(4methoxyphenyl)piperazin1yl)1oxopropan2yl)23dihydro14benzodioxine2carboxamide
N((2S)1(4(4methoxyphenyl)piperazin1yl)1oxopropan2yl)23dihydro14benzodioxine3carboxamide
N((S)1(4(4methoxyphenyl)piperazin1yl)1oxopropan2yl)23dihydrobenzo(b)(14)dioxine2carboxamide
ZINC000012321807
ZINC000012321808

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Available files

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