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(3R)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl (4-methyl-1-piperazinyl)acetate

View entire compound with spectra: 1 NMR

(3R)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl (4-methyl-1-piperazinyl)acetate
SpectraBase Compound ID CoPBABYxNKh
InChI InChI=1S/C23H27N3O4S/c1-25-11-13-26(14-12-25)15-20(27)30-21-22(16-7-9-17(29-2)10-8-16)31-19-6-4-3-5-18(19)24-23(21)28/h3-10,21-22H,11-15H2,1-2H3,(H,24,28)
InChIKey OZMYBGOTPNDMQV-UHFFFAOYSA-N
Mol Weight 441.55 g/mol
Molecular Formula C23H27N3O4S
Exact Mass 441.172228 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F7nD3GzLTLa
Name (3R)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl (4-methyl-1-piperazinyl)acetate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H27N3O4S/c1-25-11-13-26(14-12-25)15-20(27)30-21-22(16-7-9-17(29-2)10-8-16)31-19-6-4-3-5-18(19)24-23(21)28/h3-10,21-22H,11-15H2,1-2H3,(H,24,28)
InChIKey OZMYBGOTPNDMQV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16740
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 987/00004317; Labnumber: 987/00004317218852; VK_ID: VK-016745
Synonyms 2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl (4-methyl-1-piperazinyl)acetate
Temperature 318 °C