RefChem:1071945
TL;DR: RefChem:1071945 (CAS 78311-91-8) is a chemical compound with molecular formula C25H21N3O5 and molecular weight 443.15 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-phenylmethoxyphenyl)methylidene]imidazol-4-one
Also Known As: 4H-Imidazol-4-one, 3,5-dihydro-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-((4-(phenylmethoxy)phenyl)methylene)-, (5Z)-3-(2-methoxy-4-nitro-phenyl)-2-methyl-5-[(4-phenylmethoxyphenyl)methylidene]imidazol-4-one, (5Z)-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-[(4-phenylmethoxyphenyl)methylidene]imidazol-4-one, RefChem:1071945
| Molecular Formula | C25H21N3O5 |
|---|---|
| Molecular Weight | 443.15 g/mol |
| LogP | 4.9885 |
| Topological Polar Surface Area | 94.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 443.14813 |
| Heavy Atoms | 33 |
| Complexity | 1250.7938 |
Chemical Identifiers
| CAS Number | 78311-91-8 |
|---|---|
| SMILES | CC1=N/C(=C\C2=CC=C(C=C2)OCC3=CC=CC=C3)/C(=O)N1C4=C(C=C(C=C4)[N+](=O)[O-])OC |
Product Overview
RefChem:1071945 (CAS 78311-91-8), with molecular formula C25H21N3O5 and molecular weight 443.15 g/mol. IUPAC: (5Z)-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-[(4-phenylmethoxyphenyl)methylidene]imidazol-4-one.
Chemical Property Profile of RefChem:1071945
Property Insights of RefChem:1071945
The XLogP value of 4.9885 indicates that RefChem:1071945 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.27 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1071945. Following Lipinski's Rule of Five, RefChem:1071945 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:1071945?
The CAS number of RefChem:1071945 is 78311-91-8.
What is the molecular formula of RefChem:1071945?
The molecular formula of RefChem:1071945 is C25H21N3O5.
What is the molecular weight of RefChem:1071945?
The molecular weight of RefChem:1071945 is 443.15 g/mol.
Where can I buy RefChem:1071945?
You can request a quote for RefChem:1071945 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071945?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071945 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.