RefChem:1089034
TL;DR: RefChem:1089034 (CAS 62143-83-3) is a chemical compound with molecular formula C8H10N4O3 and molecular weight 210.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-methyl-3-(3-methyl-2-nitroimidazol-4-yl)prop-2-en-1-imine oxide
Also Known As: N-Methyl-alpha-((1-methyl-2-nitro-1H-imidazol-5-yl)vinyl)nitrone, Methanamine, N-(3-(1-methyl-2-nitro-1H-imidazol-5-yl)-2-propenylidene)-, N-oxide, (E)-, (E)-N-(3-(1-Methyl-2-nitro-1H-imidazol-5-yl)-2-propenylidene)methanamine N-oxide, (E)-N-methyl-3-(3-methyl-2-nitroimidazol-4-yl)prop-2-en-1-imine oxide, RefChem:1089034
| Molecular Formula | C8H10N4O3 |
|---|---|
| Molecular Weight | 210.08 g/mol |
| LogP | 0.5524 |
| Topological Polar Surface Area | 87.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.07529 |
| Heavy Atoms | 15 |
| Complexity | 429.0952 |
Chemical Identifiers
| CAS Number | 62143-83-3 |
|---|---|
| SMILES | CN1C(=CN=C1[N+](=O)[O-])/C=C/C=[N+](/C)\[O-] |
Product Overview
RefChem:1089034 (CAS 62143-83-3), with molecular formula C8H10N4O3 and molecular weight 210.08 g/mol. IUPAC: (E)-N-methyl-3-(3-methyl-2-nitroimidazol-4-yl)prop-2-en-1-imine oxide.
Chemical Property Profile of RefChem:1089034
Property Insights of RefChem:1089034
The XLogP value of 0.5524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1089034. The TPSA of 87.03 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1089034. Following Lipinski's Rule of Five, RefChem:1089034 has 0 hydrogen bond donor(s) and 4 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 RefChem:1089034?
The CAS number of RefChem:1089034 is 62143-83-3.
What is the molecular formula of RefChem:1089034?
The molecular formula of RefChem:1089034 is C8H10N4O3.
What is the molecular weight of RefChem:1089034?
The molecular weight of RefChem:1089034 is 210.08 g/mol.
Where can I buy RefChem:1089034?
You can request a quote for RefChem:1089034 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1089034?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1089034 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.