4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE
TL;DR: 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE (CAS 609795-70-2) is a chemical compound with molecular formula C24H21Cl2N3O4S and molecular weight 517.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-butoxyphenyl)-hydroxymethylidene]-5-(3,4-dichlorophenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 4-(4-Butoxybenzoyl)-5-(3,4-dichlorophenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one, 4-[(4-butoxyphenyl)-hydroxymethylidene]-5-(3,4-dichlorophenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione, 647-010-7, RefChem:513988
| Molecular Formula | C24H21Cl2N3O4S |
|---|---|
| Molecular Weight | 517.06 g/mol |
| LogP | 5.95852 |
| Topological Polar Surface Area | 92.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 517.063 |
| Heavy Atoms | 34 |
| Complexity | 1273.4774 |
Chemical Identifiers
| CAS Number | 609795-70-2 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NN=C(S3)C)C4=CC(=C(C=C4)Cl)Cl)O |
Product Overview
4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE (CAS 609795-70-2), with molecular formula C24H21Cl2N3O4S and molecular weight 517.06 g/mol. IUPAC: 4-[(4-butoxyphenyl)-hydroxymethylidene]-5-(3,4-dichlorophenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE
Property Insights of 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE
The XLogP value of 5.95852 indicates that 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE 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 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE. Following Lipinski's Rule of Five, 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE 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 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE?
The CAS number of 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE is 609795-70-2.
What is the molecular formula of 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE?
The molecular formula of 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE is C24H21Cl2N3O4S.
What is the molecular weight of 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE?
The molecular weight of 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE is 517.06 g/mol.
Where can I buy 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE?
You can request a quote for 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-BUTOXYBENZOYL)-5-(3,4-DICHLOROPHENYL)-3-HYDROXY-1-(5-METHYL-1,3,4-THIADIAZOL-2-YL)-1,5-DIHYDRO-2H-PYRROL-2-ONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.