WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 122207
CAS#: N/A
Description: P131 is a PROTAC molecule comprised of Pomalidomide-based cereblon ligand and IBT6A, linked by a PEG 3 chain. P131 was initial developed by Sun (2018) that can degrade both wild-type and C481S mutant BTK with nanomolar potencies.
MedKoo Cat#: 122207
Name: P131
CAS#: N/A
Chemical Formula: C46H48N12O9
Exact Mass: 912.3667
Molecular Weight: 912.965
Elemental Analysis: C, 60.52; H, 5.30; N, 18.41; O, 15.77
Synonym: P131
IUPAC/Chemical Name: 4-((2-(2-(2-(2-(4-((S)-3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carbonyl)-1H-1,2,3-triazol-1-yl)ethoxy)ethoxy)ethoxy)ethyl)amino)-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione
InChi Key: DAKOVCJVMZQQAH-GYSVSWRBSA-N
InChi Code: InChI=1S/C46H48N12O9/c47-41-39-40(29-11-13-32(14-12-29)67-31-7-2-1-3-8-31)53-58(42(39)50-28-49-41)30-6-5-18-55(26-30)45(62)35-27-56(54-52-35)19-21-65-23-25-66-24-22-64-20-17-48-34-10-4-9-33-38(34)46(63)57(44(33)61)36-15-16-37(59)51-43(36)60/h1-4,7-14,27-28,30,36,48H,5-6,15-26H2,(H2,47,49,50)(H,51,59,60)/t30-,36?/m0/s1
SMILES Code: O=C1NC(C(N2C(C3=C(NCCOCCOCCOCCN4N=NC(C(N5C[C@@H](N6N=C(C7=CC=C(OC8=CC=CC=C8)C=C7)C9=C6N=CN=C9N)CCC5)=O)=C4)C=CC=C3C2=O)=O)CC1)=O
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
The following data is based on the product molecular weight 912.965 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 |
