RefChem:1071946
TL;DR: RefChem:1071946 (CAS 78311-92-9) is a chemical compound with molecular formula C18H14N4O6 and molecular weight 382.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-[(4-nitrophenyl)methylidene]imidazol-4-one
Also Known As: 4H-Imidazol-4-one, 3,5-dihydro-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-((4-nitrophenyl)methylene)-, (5Z)-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-[(4-nitrophenyl)methylidene]imidazol-4-one, RefChem:1071946
| Molecular Formula | C18H14N4O6 |
|---|---|
| Molecular Weight | 382.09 g/mol |
| LogP | 3.3177 |
| Topological Polar Surface Area | 128.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.09134 |
| Heavy Atoms | 28 |
| Complexity | 1042.5414 |
Chemical Identifiers
| CAS Number | 78311-92-9 |
|---|---|
| SMILES | CC1=N/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)N1C3=C(C=C(C=C3)[N+](=O)[O-])OC |
Product Overview
RefChem:1071946 (CAS 78311-92-9), with molecular formula C18H14N4O6 and molecular weight 382.09 g/mol. IUPAC: (5Z)-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-[(4-nitrophenyl)methylidene]imidazol-4-one.
Chemical Property Profile of RefChem:1071946
Property Insights of RefChem:1071946
The XLogP value of 3.3177 indicates that RefChem:1071946 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.18 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1071946. Following Lipinski's Rule of Five, RefChem:1071946 has 0 hydrogen bond donor(s) and 7 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:1071946?
The CAS number of RefChem:1071946 is 78311-92-9.
What is the molecular formula of RefChem:1071946?
The molecular formula of RefChem:1071946 is C18H14N4O6.
What is the molecular weight of RefChem:1071946?
The molecular weight of RefChem:1071946 is 382.09 g/mol.
Where can I buy RefChem:1071946?
You can request a quote for RefChem:1071946 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071946?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071946 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.