Description
BRCA1-IN-2 (compound 15) is a cell-permeable protein-protein interaction (PPI) inhibitor for BRCA1 with an IC50 of 0.31 μM and a Kd of 0.3 μM, which shows antitumor activities via the disruption of BRCA1 (BRCT)2/protein interactions.
Product information
CAS Number: 1622262-55-8
Molecular Weight: 544.54
Formula: C26H33N4O7P
Chemical Name: [(2S)-2-[3-(1H-indol-3-yl)propanamido]-2-({[(4-phenylbutyl)carbamoyl]methyl}carbamoyl)ethoxy]phosphonic acid
Smiles: OP(O)(=O)OC[C@H](NC(=O)CCC1=CNC2=CC=CC=C12)C(=O)NCC(=O)NCCCCC1C=CC=CC=1
InChiKey: TYEYIJQDNULZJQ-QHCPKHFHSA-N
InChi: InChI=1S/C26H33N4O7P/c31-24(14-13-20-16-28-22-12-5-4-11-21(20)22)30-23(18-37-38(34,35)36)26(33)29-17-25(32)27-15-7-6-10-19-8-2-1-3-9-19/h1-5,8-9,11-12,16,23,28H,6-7,10,13-15,17-18H2,(H,27,32)(H,29,33)(H,30,31)(H2,34,35,36)/t23-/m0/s1
Technical Data
Appearance: Solid Power
Purity: ≥98% (or refer to the Certificate of Analysis)
Solubility: DMSO : 100 mg/mL (183.64 mM; Need ultrasonic).
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical or refer to Certificate of Analysis
Storage Condition: Dry, dark and -20 oC for 1 year or refer to the Certificate of Analysis.
Shelf Life: ≥12 months if stored properly.
Stock Solution Storage: 0 - 4 oC for 1 month or refer to the Certificate of Analysis.
Drug Formulation: To be determined
HS Tariff Code: 382200
Products are for research use only. Not for human use.
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