RefChem:1057999
TL;DR: RefChem:1057999 (CAS 134221-13-9) is a chemical compound with molecular formula C14H18ClN5O3 and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[1-[(4-methoxy-3-nitrophenyl)methyl]imidazol-2-yl]methylideneamino]-N-methylmethanamine;hydrochloride
Also Known As: 1H-Imidazole-2-carboxaldehyde, 1-((4-methoxy-3-nitrophenyl)methyl)-, dimethylhydrazone, monohydrochloride, 1H-Imidazole-2-carboxaldehyde,1-((4-methoxy-3-nitrophenyl)methyl)-,dimethylhydrazone,monohydrochloride, N-[(E)-[1-[(4-methoxy-3-nitrophenyl)methyl]imidazol-2-yl]methylideneamino]-N-methylmethanamine,hydrochloride, RefChem:1057999
| Molecular Formula | C14H18ClN5O3 |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | 2.1655 |
| Topological Polar Surface Area | 85.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 339.1098 |
| Heavy Atoms | 23 |
| Complexity | 699.47125 |
Chemical Identifiers
| CAS Number | 134221-13-9 |
|---|---|
| SMILES | CN(C)/N=C/C1=NC=CN1CC2=CC(=C(C=C2)OC)[N+](=O)[O-].Cl |
Product Overview
RefChem:1057999 (CAS 134221-13-9), with molecular formula C14H18ClN5O3 and molecular weight 339.11 g/mol. IUPAC: N-[(E)-[1-[(4-methoxy-3-nitrophenyl)methyl]imidazol-2-yl]methylideneamino]-N-methylmethanamine;hydrochloride.
Chemical Property Profile of RefChem:1057999
Property Insights of RefChem:1057999
The XLogP value of 2.1655 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1057999. The TPSA of 85.79 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1057999. Following Lipinski's Rule of Five, RefChem:1057999 has 0 hydrogen bond donor(s) and 6 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:1057999?
The CAS number of RefChem:1057999 is 134221-13-9.
What is the molecular formula of RefChem:1057999?
The molecular formula of RefChem:1057999 is C14H18ClN5O3.
What is the molecular weight of RefChem:1057999?
The molecular weight of RefChem:1057999 is 339.11 g/mol.
Where can I buy RefChem:1057999?
You can request a quote for RefChem:1057999 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1057999?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1057999 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.