Technetium-99m nitroimidazole
TL;DR: Technetium-99m nitroimidazole (CAS 149447-21-2) is a chemical compound with molecular formula C16H26N7O5Tc and molecular weight 495.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hydron;[(3E)-2-methyl-4-(2-nitroimidazol-1-yl)-3-oxidoiminobutan-2-yl]-[3-[(3E)-2-methyl-3-oxidoiminobutan-2-yl]azanidylpropyl]azanide;oxo(99Tc)technetium-99(3+)
Also Known As: Technetium-99m nitroimidazole, Bms 181321, BMS-181032 (ligand), Technetium Tc 99m bms 181321, hydron;[(3E)-2-methyl-4-(2-nitroimidazol-1-yl)-3-oxidoiminobutan-2-yl]-[3-[(3E)-2-methyl-3-oxidoiminobutan-2-yl]azanidylpropyl]azanide;oxo(99Tc)technetium-99(3+)
| Molecular Formula | C16H26N7O5Tc |
|---|---|
| Molecular Weight | 495.11 g/mol |
| LogP | 3.3747 |
| Topological Polar Surface Area | 177.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 495.1058 |
| Heavy Atoms | 29 |
| Complexity | 724.592 |
Chemical Identifiers
| CAS Number | 149447-21-2 |
|---|---|
| SMILES | [H+].C/C(=N\[O-])/C(C)(C)[N-]CCC[N-]C(C)(C)/C(=N/[O-])/CN1C=CN=C1[N+](=O)[O-].O=[99Tc+3] |
Product Overview
Technetium-99m nitroimidazole (CAS 149447-21-2), with molecular formula C16H26N7O5Tc and molecular weight 495.11 g/mol. IUPAC: hydron;[(3E)-2-methyl-4-(2-nitroimidazol-1-yl)-3-oxidoiminobutan-2-yl]-[3-[(3E)-2-methyl-3-oxidoiminobutan-2-yl]azanidylpropyl]azanide;oxo(99Tc)technetium-99(3+).
Chemical Property Profile of Technetium-99m nitroimidazole
Property Insights of Technetium-99m nitroimidazole
The XLogP value of 3.3747 indicates that Technetium-99m nitroimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 177.07 Ų indicates high polarity, suggesting Technetium-99m nitroimidazole may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Technetium-99m nitroimidazole has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Technetium-99m nitroimidazole?
The CAS number of Technetium-99m nitroimidazole is 149447-21-2.
What is the molecular formula of Technetium-99m nitroimidazole?
The molecular formula of Technetium-99m nitroimidazole is C16H26N7O5Tc.
What is the molecular weight of Technetium-99m nitroimidazole?
The molecular weight of Technetium-99m nitroimidazole is 495.11 g/mol.
Where can I buy Technetium-99m nitroimidazole?
You can request a quote for Technetium-99m nitroimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Technetium-99m nitroimidazole?
Yes, KEHONG BIO provides custom synthesis services for Technetium-99m nitroimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.