Synonym
ITH-12575; ITH 12575; ITH12575.
IUPAC/Chemical Name
7-Chloro-1,5-dihydro-5-[2-(1-methylethyl)phenyl]-4,1-benzothiazepin-2(3H)-one
InChi Key
RDMUJSJZBYAAEF-UHFFFAOYSA-N
InChi Code
InChI=1S/C18H18ClNOS/c1-11(2)13-5-3-4-6-14(13)18-15-9-12(19)7-8-16(15)20-17(21)10-22-18/h3-9,11,18H,10H2,1-2H3,(H,20,21)
SMILES Code
O=C1NC2=CC=C(Cl)C=C2C(C3=CC=CC=C3C(C)C)SC1
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
Preparing Stock Solutions
The following data is based on the
product
molecular weight
331.86
Batch specific molecular weights may vary
from batch to batch
due to the degree of hydration, which will
affect the solvent
volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass |
1 mg |
5 mg |
10 mg |
| 1 mM |
1.15 mL |
5.76 mL |
11.51 mL |
| 5 mM |
0.23 mL |
1.15 mL |
2.3 mL |
| 10 mM |
0.12 mL |
0.58 mL |
1.15 mL |
| 50 mM |
0.02 mL |
0.12 mL |
0.23 mL |
1: Moreno-Ortega AJ, Martínez-Sanz FJ, Lajarín-Cuesta R, de Los Rios C, Cano-Abad
MF. Benzothiazepine CGP37157 and its 2'-isopropyl analogue modulate Ca²⁺ entry
through CALHM1. Neuropharmacology. 2015 Aug;95:503-10. doi:
10.1016/j.neuropharm.2015.02.016. PubMed PMID: 25908402.
2: Martínez-Sanz FJ, Lajarín-Cuesta R, González-Lafuente L, Moreno-Ortega AJ,
Punzón E, Cano-Abad MF, de los Ríos C. Neuroprotective profile of
pyridothiazepines with blocking activity of the mitochondrial Na(+)/Ca(2+)
exchanger. Eur J Med Chem. 2016 Feb 15;109:114-23. doi:
10.1016/j.ejmech.2015.12.043. PubMed PMID: 26774037.
3: Martínez-Sanz FJ, Lajarín-Cuesta R, Moreno-Ortega AJ, González-Lafuente L,
Fernández-Morales JC, López-Arribas R, Cano-Abad MF, de los Ríos C.
Benzothiazepine CGP37157 Analogues Exert Cytoprotection in Various in Vitro
Models of Neurodegeneration. ACS Chem Neurosci. 2015 Sep 16;6(9):1626-36. doi:
10.1021/acschemneuro.5b00161. PubMed PMID: 26192029.
