RefChem:1071997
TL;DR: RefChem:1071997 (CAS 78311-90-7) is a chemical compound with molecular formula C20H20N4O4 and molecular weight 380.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[4-(dimethylamino)phenyl]methylidene]-3-(2-methoxy-4-nitrophenyl)-2-methylimidazol-4-one
Also Known As: 4H-Imidazol-4-one, 3,5-dihydro-5-((4-(dimethylamino)phenyl)methylene)-3-(2-methoxy-4-nitrophenyl)-2-methyl-, (5Z)-5-[(4-dimethylaminophenyl)methylidene]-3-(2-methoxy-4-nitro-phenyl)-2-methyl-imidazol-4-one, (5Z)-5-[(4-dimethylaminophenyl)methylidene]-3-(2-methoxy-4-nitrophenyl)-2-methylimidazol-4-one, RefChem:1071997
| Molecular Formula | C20H20N4O4 |
|---|---|
| Molecular Weight | 380.15 g/mol |
| LogP | 3.4755 |
| Topological Polar Surface Area | 88.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.14847 |
| Heavy Atoms | 28 |
| Complexity | 993.7653 |
Chemical Identifiers
| CAS Number | 78311-90-7 |
|---|---|
| SMILES | CC1=N/C(=C\C2=CC=C(C=C2)N(C)C)/C(=O)N1C3=C(C=C(C=C3)[N+](=O)[O-])OC |
Product Overview
RefChem:1071997 (CAS 78311-90-7), with molecular formula C20H20N4O4 and molecular weight 380.15 g/mol. IUPAC: (5Z)-5-[[4-(dimethylamino)phenyl]methylidene]-3-(2-methoxy-4-nitrophenyl)-2-methylimidazol-4-one.
Chemical Property Profile of RefChem:1071997
Property Insights of RefChem:1071997
The XLogP value of 3.4755 indicates that RefChem:1071997 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.28 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1071997. Following Lipinski's Rule of Five, RefChem:1071997 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:1071997?
The CAS number of RefChem:1071997 is 78311-90-7.
What is the molecular formula of RefChem:1071997?
The molecular formula of RefChem:1071997 is C20H20N4O4.
What is the molecular weight of RefChem:1071997?
The molecular weight of RefChem:1071997 is 380.15 g/mol.
Where can I buy RefChem:1071997?
You can request a quote for RefChem:1071997 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071997?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071997 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.