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Chemical structure of TH-302

GC11298

TH-302

Also known as 2-bromo-N-[(2-bromoethylamino)-[(3-methyl-2-nitroimidazol-4-yl)methoxy]phosphoryl]ethanamine

A hypoxia-activated anticancer agent

ChemicalCAS918633-87-1MW449.04FormulaC9H16Br2N5O4P
CAS number
918633-87-1
Molecular weight
449.04
Formula
C9H16Br2N5O4P
Solubility
≥ 22·45 mg/mL in DMSO, ≥ 34·2 mg/mL in EtOH with ultrasonic, ≥ 4·73 mg/mL in Water with ultrasonic and warming
InChIKey
UGJWRPJDTDGERK-UHFFFAOYSA-N
Catalogue number
GC11298
Brand
GLPBIO
Computed properties PubChem CID 11984561 · XLogP 0.6 · TPSA 114 Ų · H-bond donors 2
XLogP
0.6
TPSA
114 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
21

SMILES CN1C(=CN=C1[N+](=O)[O-])COP(=O)(NCCBr)NCCBr

Computed descriptors from PubChem (CID 11984561), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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