Iodine I 131 iodoerythronitroimidazole
TL;DR: Iodine I 131 iodoerythronitroimidazole (CAS 179036-52-3) is a chemical compound with molecular formula C7H10IN3O4 and molecular weight 330.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(131I)iodo-4-(2-nitroimidazol-1-yl)butane-2,3-diol
Also Known As: Brasilinolide a, Iodine I 131 iodoerythronitroimidazole, 1-iodanyl-4-(2-nitroimidazol-1-yl)butane-2,3-diol, 1-(Iodo-131I)-4-(2-nitro-1H-imidazol-1-yl)-2,3-butanediol, 2,3-Butanediol, 1-(iodo-131I)-4-(2-nitro-1H-imidazol-1-yl)-
| Molecular Formula | C7H10IN3O4 |
|---|---|
| Molecular Weight | 330.97 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.97327 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 179036-52-3 |
|---|---|
| SMILES | C1=CN(C(=N1)[N+](=O)[O-])CC(C(C[131I])O)O |
| InChIKey | KUKMENZMYIDZMK-KPKJHWAZSA-N |
Product Overview
Iodine I 131 iodoerythronitroimidazole (CAS 179036-52-3), with molecular formula C7H10IN3O4 and molecular weight 330.97 g/mol. IUPAC: 1-(131I)iodo-4-(2-nitroimidazol-1-yl)butane-2,3-diol.
Chemical Property Profile of Iodine I 131 iodoerythronitroimidazole
Property Insights of Iodine I 131 iodoerythronitroimidazole
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iodine I 131 iodoerythronitroimidazole. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Iodine I 131 iodoerythronitroimidazole. Following Lipinski's Rule of Five, Iodine I 131 iodoerythronitroimidazole has 2 hydrogen bond donor(s) and 5 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 Iodine I 131 iodoerythronitroimidazole?
The CAS number of Iodine I 131 iodoerythronitroimidazole is 179036-52-3.
What is the molecular formula of Iodine I 131 iodoerythronitroimidazole?
The molecular formula of Iodine I 131 iodoerythronitroimidazole is C7H10IN3O4.
What is the molecular weight of Iodine I 131 iodoerythronitroimidazole?
The molecular weight of Iodine I 131 iodoerythronitroimidazole is 330.97 g/mol.
Where can I buy Iodine I 131 iodoerythronitroimidazole?
You can request a quote for Iodine I 131 iodoerythronitroimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iodine I 131 iodoerythronitroimidazole?
Yes, KEHONG BIO provides custom synthesis services for Iodine I 131 iodoerythronitroimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.