WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H123389
CAS#: N/A
Description: JNJ-78394355 is a Mcl-1 inhibitor.
Hodoodo Cat#: H123389
Name: JNJ-78394355
CAS#: N/A
Chemical Formula: C40H44ClN5O5S
Exact Mass: 741.28
Molecular Weight: 742.330
Elemental Analysis: C, 64.72; H, 5.97; Cl, 4.78; N, 9.43; O, 10.78; S, 4.32
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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
More Info:
Biological target: | |
In vitro activity: | |
In vivo activity: |
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 |
Formulation protocol: | |
In vitro protocol: | |
In vivo protocol: |
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