Synonym
JNJ-78394355; JNJ 78394355; JNJ78394355
IUPAC/Chemical Name
(Z)-15-chloro-21-(2-(2-methoxyethoxy)ethyl)-13,23,61-trimethyl-11H,21H,61H-10-oxa-4-thia-1(4,1)-indola-2(4,5),6(3,5)-dipyrazola-9(3,1)-naphthalenacyclotridecaphane-12-carboxylic acid
InChi Key
WREPOKHXPHVMBY-UHFFFAOYSA-N
InChi Code
InChI=1S/C40H44ClN5O5S/c1-25-36-33-13-12-32(41)38(36)37-26(2)42-46(15-17-50-19-18-49-4)34(37)24-52-23-29-22-30(44(3)43-29)11-10-27-20-28-8-5-6-9-31(28)35(21-27)51-16-7-14-45(33)39(25)40(47)48/h5-6,8-9,12-13,20-22H,7,10-11,14-19,23-24H2,1-4H3,(H,47,48)
SMILES Code
CC1=NN(CCOCCOC)C(CSC2)=C1C3=C(C4=CC=C3Cl)C(C)=C(C(O)=O)N4CCCOC5=CC(CCC6=CC2=NN6C)=CC7=C5C=CC=C7
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
742.33
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 |
Discovery of an Oral, Beyond-Rule-of-Five Mcl-1 Protein–Protein Interaction Modulator with the Potential of Treating Hematological Malignancies
Fedor Romanov-Michailidis, Chien-Chi Hsiao, Lorenz M. Urner, Soufyan Jerhaoui, Michel Surkyn, Bradley Miller, Ann Vos, Maria Dominguez Blanco, Ruud Bueters, Petra Vinken, Mariette Bekkers, David Walker, Beth Pietrak, Werner Eyckmans, José Luís Dores-Sousa, Seong Joo Koo, William Lento, Marcus Bauser, Ulrike Philippar, and Frederik J. R. Rombouts
Journal of Medicinal Chemistry Article ASAP
DOI: 10.1021/acs.jmedchem.2c01953