![1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one structure](/static/products/7050/7050-73-9.webp)
1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
TL;DR: 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one (CAS 7050-73-9) is a chemical compound with molecular formula C29H18Cl2N4O7S2 and molecular weight 668.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one
Also Known As: 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one, 1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one
| Molecular Formula | C29H18Cl2N4O7S2 |
|---|---|
| Molecular Weight | 668.00 g/mol |
| LogP | 7.5831 |
| Topological Polar Surface Area | 148.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 667.9994 |
| Heavy Atoms | 44 |
| Complexity | 2008.5181 |
Chemical Identifiers
| CAS Number | 7050-73-9 |
|---|---|
| SMILES | COC1=CC=CC2=C1OC(=C2)C(=O)C3=C(C(=O)N(C3C4=CC(=CC=C4)[N+](=O)[O-])C5=NN=C(S5)SCC6=C(C=C(C=C6)Cl)Cl)O |
Product Overview
1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one (CAS 7050-73-9), with molecular formula C29H18Cl2N4O7S2 and molecular weight 668.00 g/mol. IUPAC: 1-[5-[(2,4-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(3-nitrophenyl)-2H-pyrrol-5-one.
Chemical Property Profile of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Property Insights of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
The XLogP value of 7.5831 indicates that 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.9 Ų indicates high polarity, suggesting 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one?
The CAS number of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one is 7050-73-9.
What is the molecular formula of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one?
The molecular formula of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one is C29H18Cl2N4O7S2.
What is the molecular weight of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one?
The molecular weight of 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one is 668.00 g/mol.
Where can I buy 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one?
You can request a quote for 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-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 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-{[(2,4-Dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.