Vitas-M small molecule compound
2,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3-yl[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]methanone
Catalog ID
STL410224
SMILES COc1ccc(c(c1OC)OC)CN1CCN(CC1)C(=O)c1[nH]nc2c1CCCCC2
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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 C23H32N4O4 MW 428.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N4O4/c1-29-19-10-9-16(21(30-2)22(19)31-3)15-26-11-13-27(14-12-26)23(28)20-17-7-5-4-6-8-18(17)24-25-20/h9-10H,4-8,11-15H2,1-3H3,(H,24,25)InChIKey
QKDSLOXRIYDBPJ-UHFFFAOYSA-NSynonyms
1574295-71-8(145678hexahydrocyclohepta(c)pyrazol3yl)(4(234trimethoxybenzyl)piperazin1yl)methanone
145678hexahydrocyclohepta(c)pyrazol3yl(4((234trimethoxyphenyl)methyl)piperazin1yl)methanone
1574295718
245678hexahydrocyclohepta(c)pyrazol3yl(4(234trimethoxybenzyl)piperazin1yl)methanone
COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)C3=NNC4=C3CCCCC4)OC)OC
COc1ccc(c(c1OC)OC)CN1CCN(CC1)C(=O)c1(nH)nc2c1CCCCC2
COc1ccc(c(c1OC)OC)CN1CCN(CC1)C(=O)c1n(nH)c2c1CCCCC2
InChI=1SC23H32N4O4c1291910916(21(302)22(19)313)1526111327(141226)23(28)20177546818(17)242520h910H481115H213H3(H2425)
MFCD30706097
ZINC000096231985
ZINC96231985
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