RefChem:1069140
TL;DR: RefChem:1069140 (CAS 114496-22-9) is a chemical compound with molecular formula C22H20N4O4 and molecular weight 404.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(3,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]-2-methylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 3-(4-((3,4-dimethoxyphenyl)methylene)-4,5-dihydro-2-methyl-5-oxo-1H-imidazol-1-yl)-2-methyl-, 3-[4-[(3,4-Dimethoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]-2-methylquinazolin-4-one, RefChem:1069140
| Molecular Formula | C22H20N4O4 |
|---|---|
| Molecular Weight | 404.15 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.14847 |
| Heavy Atoms | 30 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 114496-22-9 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1N3C(=NC(=CC4=CC(=C(C=C4)OC)OC)C3=O)C |
| InChIKey | UMLLNSGMRQCVRD-UHFFFAOYSA-N |
Product Overview
RefChem:1069140 (CAS 114496-22-9), with molecular formula C22H20N4O4 and molecular weight 404.15 g/mol. IUPAC: 3-[4-[(3,4-dimethoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]-2-methylquinazolin-4-one.
Chemical Property Profile of RefChem:1069140
Property Insights of RefChem:1069140
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1069140. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1069140. Following Lipinski's Rule of Five, RefChem:1069140 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:1069140?
The CAS number of RefChem:1069140 is 114496-22-9.
What is the molecular formula of RefChem:1069140?
The molecular formula of RefChem:1069140 is C22H20N4O4.
What is the molecular weight of RefChem:1069140?
The molecular weight of RefChem:1069140 is 404.15 g/mol.
Where can I buy RefChem:1069140?
You can request a quote for RefChem:1069140 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1069140?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1069140 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.