Synonym
PB-94; PB94; PB 94
IUPAC/Chemical Name
N-(((3r,5r,7r)-adamantan-1-yl)methyl)-1-(4-(hydroxycarbamoyl)-3-methoxybenzyl)-1H-indole-5-carboxamide
InChi Key
JJMWRKOHPNUEJN-CTZVOZSRSA-N
InChi Code
InChI=1S/C29H33N3O4/c1-36-26-11-18(2-4-24(26)28(34)31-35)16-32-7-6-22-12-23(3-5-25(22)32)27(33)30-17-29-13-19-8-20(14-29)10-21(9-19)15-29/h2-7,11-12,19-21,35H,8-10,13-17H2,1H3,(H,30,33)(H,31,34)/t19-,20+,21-,29?
SMILES Code
O=C(C1=CC=C(N(CC2=CC(OC)=C(C(NO)=O)C=C2)C=C3)C3=C1)NCC45C[C@@H]6C[C@@H](C[C@@H](C6)C5)C4
Appearance
To be determined
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
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
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
487.60
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: Bai P, Liu Y, Yang L, Ding W, Mondal P, Sang N, Liu G, Lu X, Ho TT, Zhou Y,
Wu R, Birar VC, Wilks MQ, Tanzi RE, Lin H, Zhang C, Li W, Shen S, Wang C.
Development and Pharmacochemical Characterization Discover a Novel Brain-
Permeable HDAC11-Selective Inhibitor with Therapeutic Potential by Regulating
Neuroinflammation in Mice. J Med Chem. 2023 Nov 16. doi:
10.1021/acs.jmedchem.3c01491. Epub ahead of print. PMID: 37972387.
2: Tejel C, Sommovigo M, Ciriano MA, López JA, Lahoz FJ, Oro LA. Rhodium-Rhodium
Bonds in Edge-Sharing Coplanar Dinuclear Complexes Generous financial support
from DGES (Projects PB98-641, PB95-318, and PB94-1186) and a fellowship (to
M.S.) are gratefully acknowledged. Angew Chem Int Ed Engl. 2000 Jul
3;39(13):2336-2339. PMID: 10941083.
3: Argilés A, García-García M, Derancourt J, Mourad G, Demaille JG. Beta 2
microglobulin isoforms in healthy individuals and in amyloid deposits. Kidney
Int. 1995 Nov;48(5):1397-405. doi: 10.1038/ki.1995.428. PMID: 8544395.
4: Allen RJ, Scott GK. Comparison of the effects of different
lipopolysaccharides on the serum bactericidal reactions of two strains of
Escherichia coli. Infect Immun. 1981 Feb;31(2):831-2. doi:
10.1128/iai.31.2.831-832.1981. PMID: 7012024; PMCID: PMC351386.