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Chemical structure of PF-07304814

GC62692

PF-07304814

Also known as [(3S)-3-[[(2S)-2-[(4-methoxy-1H-indole-2-carbonyl)amino]-4-methylpentanoyl]amino]-2-oxo-4-[(3S)-2-oxopyrrolidin-3-yl]butyl] dihydrogen phosphate

PF-07304814 (PF-07304814), a phosphate prodrug of PF-00835231, acts as a potent 3CLproprotease (Mpro) inhibitor with SARS-CoV-2 antiviral activity

ChemicalCAS2468015-78-1MW552.51FormulaC24H33N4O9P
CAS number
2468015-78-1
Molecular weight
552.51
Formula
C24H33N4O9P
Solubility
DMSO ： 130 mg/mL (235·29 mM; Need ultrasonic); H2O ： 50 mg/mL (90·50 mM; Need ultrasonic)
InChIKey
FQKALOFOWPDTED-WBAXXEDZSA-N
Catalogue number
GC62692
Brand
GLPBIO
Computed properties PubChem CID 154699467 · XLogP 0.5 · TPSA 196 Ų · H-bond donors 6
XLogP
0.5
TPSA
196 Ų
H-bond donors
6
H-bond acceptors
9
Rotatable bonds
13
Heavy atoms
38

SMILES CC(C)C[C@@H](C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)COP(=O)(O)O)NC(=O)C2=CC3=C(N2)C=CC=C3OC

Computed descriptors from PubChem (CID 154699467), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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