Vitas-M small molecule compound
3-{[4-(2,3-difluorobenzyl)piperazin-1-yl]carbonyl}-7,8,9,10-tetrahydroazepino[2,1-b]quinazolin-12(6H)-one
Catalog ID
STL175791
SMILES O=C(c1ccc2c(c1)nc1n(c2=O)CCCCC1)N1CCN(CC1)Cc1cccc(c1F)F
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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 C25H26F2N4O2 MW 452.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26F2N4O2/c26-20-6-4-5-18(23(20)27)16-29-11-13-30(14-12-29)24(32)17-8-9-19-21(15-17)28-22-7-2-1-3-10-31(22)25(19)33/h4-6,8-9,15H,1-3,7,10-14,16H2InChIKey
PIPMRQKQZGTTMI-UHFFFAOYSA-NSynonyms
938017-01-73((4(23difluorobenzyl)piperazin1yl)carbonyl)78910tetrahydroazepino(21b)quinazolin12(6H)one
3(4((23difluorophenyl)methyl)piperazine1carbonyl)78910tetrahydro6Hazepino(21b)quinazolin12one
938017017
C1CCC2=NC3=C(C=CC(=C3)C(=O)N4CCN(CC4)CC5=C(C(=CC=C5)F)F)C(=O)N2CC1
InChI=1SC25H26F2N4O2c262064518(23(20)27)1629111330(141229)24(32)17891921(1517)282272131031(22)25(19)33h468915H137101416H2
MFCD08555315
ZINC000036613892
ZINC36613892
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