Vitas-M small molecule compound
1'-(2,2-dimethylpropanoyl)-5'-methyl-2'-[(4-pentylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL048727
SMILES CCCCCc1ccc(cc1)C(=O)C1C(N2C(C31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C)C(=O)C(C)(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 C37H40N2O3 MW 560.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H40N2O3/c1-6-7-8-13-24-18-20-25(21-19-24)33(40)31-32(34(41)36(3,4)5)39-29-17-12-9-14-26(29)23(2)22-30(39)37(31)27-15-10-11-16-28(27)38-35(37)42/h9-12,14-22,30-32H,6-8,13H2,1-5H3,(H,38,42)InChIKey
FQWBONXCEUBIIV-UHFFFAOYSA-NSynonyms
(1S2S3R3aR)5methyl2(4pentylbenzoyl)1pivaloyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1(22dimethylpropanoyl)5methyl2((4pentylphenyl)carbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
1(22dimethylpropanoyl)5methyl2(4pentylbenzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CCCCCC1=CC=C(C=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=C(C6=CC=CC=C63)C)C(=O)C(C)(C)C
CCCCCc1ccc(cc1)C(=O)(C@@H)1(C@H)(N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=C(c1c2cccc1)C)C(=O)C(C)(C)C
InChI=1SC37H40N2O3c16781324182025(211924)33(40)3132(34(41)36(34)5)3929171291426(29)23(2)2230(39)37(31)271510111628(27)3835(37)42h91214223032H6813H215H3(H3842)
MFCD05730041
ZINC000102884644
ZINC000245245661
Check stock
See real-time availability and sample size for STL048727 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.