EPZ0156666, PRMT5 inhibitor

주요 정보

CAS 번호

1616391-65-1

Purity

>98%

제형

Solid

form

Molecular weight

383.4 Da

Molecular formula

C₂₀H₂₅N₅O₃

PubChem

90241673

Nature

Synthetic

Solubility

Soluble in DMSO to 50 mM

생화학적 명칭

(S)-N-(3-(3,4-Dihydroisoquinolin-2(1H)-yl)-2-hydroxypropyl)-6-(oxetan-3-ylamino)pyrimidine-4-carboxamide

생물학적 정보

Selective, potent (IC₅₀ = 22nM, K_i =5 nM) inhibitor of arginine methyltransferase 5 (PRMT5). Displays selectivity for PRMT5 over a panel of 20 other protein methyltransferases.

Canonical SMILES

C1CN(CC2=CC=CC=C21)CC(CNC(=O)C3=CC(=NC=N3)NC4COC4)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C[C@H](CNC(=O)C3=CC(=NC=N3)NC4COC4)O

InChi

InChI=1S/C20H25N5O3/c26-17(10-25-6-5-14-3-1-2-4-15(14)9-25)8-21-20(27)18-7-19(23-13-22-18)24-16-11-28-12-16/h1-4,7,13,16-17,26H,5-6,8-12H2,(H,21,27)(H,22,23,24)/t17-/m0/s1

InChiKey

ZKXZLIFRWWKZRY-KRWDZBQOSA-N

IUPAC Name

N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-6-(oxetan-3-ylamino)pyrimidine-4-carboxamide