RefChem:514137
TL;DR: RefChem:514137 (CAS 618073-32-8) is a chemical compound with molecular formula C26H27N3O4S and molecular weight 477.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-5-(4-ethylphenyl)-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: 4-(4-Ethoxybenzoyl)-5-(4-ethylphenyl)-3-hydroxy-1-(5-isopropyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one, 4-(4-ETHOXYBENZOYL)-5-(4-ETHYLPHENYL)-3-HYDROXY-1-(5-ISOPROPYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 645-686-8, RefChem:514137
| Molecular Formula | C26H27N3O4S |
|---|---|
| Molecular Weight | 477.17 g/mol |
| LogP | 5.2489 |
| Topological Polar Surface Area | 92.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.17224 |
| Heavy Atoms | 34 |
| Complexity | 1229.6915 |
Chemical Identifiers
| CAS Number | 618073-32-8 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)OCC)\O)/C(=O)C(=O)N2C4=NN=C(S4)C(C)C |
Product Overview
RefChem:514137 (CAS 618073-32-8), with molecular formula C26H27N3O4S and molecular weight 477.17 g/mol. IUPAC: (4E)-4-[(4-ethoxyphenyl)-hydroxymethylidene]-5-(4-ethylphenyl)-1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of RefChem:514137
Property Insights of RefChem:514137
The XLogP value of 5.2489 indicates that RefChem:514137 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.62 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:514137. Following Lipinski's Rule of Five, RefChem:514137 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:514137?
The CAS number of RefChem:514137 is 618073-32-8.
What is the molecular formula of RefChem:514137?
The molecular formula of RefChem:514137 is C26H27N3O4S.
What is the molecular weight of RefChem:514137?
The molecular weight of RefChem:514137 is 477.17 g/mol.
Where can I buy RefChem:514137?
You can request a quote for RefChem:514137 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:514137?
Yes, KEHONG BIO provides custom synthesis services for RefChem:514137 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.