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Chemical structure of RMC-4998

GC73678

RMC-4998

Also known as (2S)-2-[(5S)-7-[4-(dimethylamino)-4-methylpent-2-ynoyl]-1-oxo-2,7-diazaspiro[4.4]nonan-2-yl]-N-[(8S,14S)-22-ethyl-21-[2-[(1S)-1-methoxyethyl]-3-pyridinyl]-18,18-dimethyl-9,15-dioxo-16-oxa-10,22,28-triazapentacyclo[18.5.2.12,6.110,14.023,27]nonacosa-1(26),2,4,6(29),20,23(27),24-heptaen-8-yl]-3-methylbutanamide

RMC-4998 is an orally active inhibitor targeting the active or GTP-bound state of the KRASG12C mutant

ChemicalCAS2642037-07-6MW983.25FormulaC57H74N8O7
CAS number
2642037-07-6
Molecular weight
983.25
Formula
C57H74N8O7
InChIKey
VYZILERTWJIGRC-DOESOIHZSA-N
Catalogue number
GC73678
Brand
GLPBIO
Computed properties PubChem CID 156335332 · XLogP 6.7 · TPSA 159 Ų · H-bond donors 2
XLogP
6.7
TPSA
159 Ų
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
10
Heavy atoms
72

SMILES CCN1C2=C3C=C(C=C2)C4=CC=CC(=C4)C[C@@H](C(=O)N5CCC[C@H](N5)C(=O)OCC(CC3=C1C6=C(N=CC=C6)[C@H](C)OC)(C)C)NC(=O)[C@H](C(C)C)N7CC[C@@]8(C7=O)CCN(C8)C(=O)C#CC(C)(C)N(C)C

Computed descriptors from PubChem (CID 156335332), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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