RefChem:1071912
TL;DR: RefChem:1071912 (CAS 86818-94-2) is a chemical compound with molecular formula C28H26ClN3O4 and molecular weight 503.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-2-(4-chlorophenyl)-5-[(3,4-dimethoxyphenyl)methylidene]-3-(4-morpholin-4-ylphenyl)imidazol-4-one
Also Known As: 4H-Imidazol-4-one, 3,5-dihydro-2-(4-chlorophenyl)-5-((3,4-dimethoxyphenyl)methylene)-3-(4-(4-morpholinyl)phenyl)-, (5Z)-2-(4-chlorophenyl)-5-[(3,4-dimethoxyphenyl)methylidene]-3-(4-morpholin-4-ylphenyl)imidazol-4-one, RefChem:1071912, BRN 4608853
| Molecular Formula | C28H26ClN3O4 |
|---|---|
| Molecular Weight | 503.16 g/mol |
| LogP | 5.0283 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.1612 |
| Heavy Atoms | 36 |
| Complexity | 1313.6263 |
Chemical Identifiers
| CAS Number | 86818-94-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C\2/C(=O)N(C(=N2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N5CCOCC5)OC |
Product Overview
RefChem:1071912 (CAS 86818-94-2), with molecular formula C28H26ClN3O4 and molecular weight 503.16 g/mol. IUPAC: (5Z)-2-(4-chlorophenyl)-5-[(3,4-dimethoxyphenyl)methylidene]-3-(4-morpholin-4-ylphenyl)imidazol-4-one.
Chemical Property Profile of RefChem:1071912
Property Insights of RefChem:1071912
The XLogP value of 5.0283 indicates that RefChem:1071912 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1071912. Following Lipinski's Rule of Five, RefChem:1071912 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1071912?
The CAS number of RefChem:1071912 is 86818-94-2.
What is the molecular formula of RefChem:1071912?
The molecular formula of RefChem:1071912 is C28H26ClN3O4.
What is the molecular weight of RefChem:1071912?
The molecular weight of RefChem:1071912 is 503.16 g/mol.
Where can I buy RefChem:1071912?
You can request a quote for RefChem:1071912 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071912?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071912 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.