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Chemical structure of NITD-2

GC64559

NITD-2

Also known as 2-[[3-(1-benzylpyrazol-4-yl)phenyl]sulfonylamino]benzoic acid

NITD-2, a dengue virus (DENV) polymerase inhibitor, inhibits the DENV RdRp-mediated RNA elongation

ChemicalCAS1197896-79-9MW433.48FormulaC23H19N3O4S
CAS number
1197896-79-9
Molecular weight
433.48
Formula
C23H19N3O4S
InChIKey
PHQOBFYGHBBCBV-UHFFFAOYSA-N
Catalogue number
GC64559
Brand
GLPBIO
Computed properties PubChem CID 44607341 · XLogP 4.1 · TPSA 110 Ų · H-bond donors 2
XLogP
4.1
TPSA
110 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
31

SMILES C1=CC=C(C=C1)CN2C=C(C=N2)C3=CC(=CC=C3)S(=O)(=O)NC4=CC=CC=C4C(=O)O

Computed descriptors from PubChem (CID 44607341), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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