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Chemical structure of YKL-5-124

GC62294

YKL-5-124

Also known as N-[(1S)-2-(dimethylamino)-1-phenylethyl]-6,6-dimethyl-3-[[4-(prop-2-enoylamino)benzoyl]amino]-1,4-dihydropyrrolo[3,4-d]pyrazole-5-carboxamide

YKL-5-124 is a potent, selective, irreversible and covalent CDK7 inhibitor with IC50s of 53·5 nM and 9·7 nM for CDK7 and CDK7/Mat1/CycH, respectively· YKL-5-124 is >100-fold greater selective for CDK7 than CDK9 and CDK2, and inactive against CDK12 and CDK13· YKL-5-124 induces a strong cell-cycle arrest, inhibits E2F-driven gene expression, and exhibits little effect on RNA polymerase II phosphorylation status

ChemicalCAS1957203-01-8MW515.61FormulaC28H33N7O3
CAS number
1957203-01-8
Molecular weight
515.61
Formula
C28H33N7O3
Solubility
DMSO ： 250 mg/mL (484·86 mM; Need ultrasonic)
InChIKey
KPABJHHKKJIDGX-JOCHJYFZSA-N
Catalogue number
GC62294
Brand
GLPBIO
Computed properties PubChem CID 121443990 · XLogP 2 · TPSA 122 Ų · H-bond donors 4
XLogP
2
TPSA
122 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
38

SMILES CC1(C2=C(CN1C(=O)N[C@H](CN(C)C)C3=CC=CC=C3)C(=NN2)NC(=O)C4=CC=C(C=C4)NC(=O)C=C)C

Computed descriptors from PubChem (CID 121443990), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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