UPCMLD0ENAT5260587:001
TL;DR: UPCMLD0ENAT5260587:001 (CAS 623535-83-1) is a chemical compound with molecular formula C23H16FN3O5S and molecular weight 465.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-pyrrol-5-one
Also Known As: UPCMLD0ENAT5260587:001, 5-(4-fluorophenyl)-3-hydroxy-4-(7-methoxy-1-benzofuran-2-carbonyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-one, 2-(4-fluorophenyl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-pyrrol-5-one, 5-(4-fluorophenyl)-3-hydroxy-4-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C23H16FN3O5S |
|---|---|
| Molecular Weight | 465.08 g/mol |
| LogP | 4.52332 |
| Topological Polar Surface Area | 105.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 465.07947 |
| Heavy Atoms | 33 |
| Complexity | 1440.09 |
Chemical Identifiers
| CAS Number | 623535-83-1 |
|---|---|
| SMILES | CC1=NN=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=C(O3)C(=CC=C4)OC)C5=CC=C(C=C5)F |
Product Overview
UPCMLD0ENAT5260587:001 (CAS 623535-83-1), with molecular formula C23H16FN3O5S and molecular weight 465.08 g/mol. IUPAC: 2-(4-fluorophenyl)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-pyrrol-5-one.
Chemical Property Profile of UPCMLD0ENAT5260587:001
Property Insights of UPCMLD0ENAT5260587:001
The XLogP value of 4.52332 indicates that UPCMLD0ENAT5260587:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.76 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5260587:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5260587:001 has 1 hydrogen bond donor(s) and 8 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 UPCMLD0ENAT5260587:001?
The CAS number of UPCMLD0ENAT5260587:001 is 623535-83-1.
What is the molecular formula of UPCMLD0ENAT5260587:001?
The molecular formula of UPCMLD0ENAT5260587:001 is C23H16FN3O5S.
What is the molecular weight of UPCMLD0ENAT5260587:001?
The molecular weight of UPCMLD0ENAT5260587:001 is 465.08 g/mol.
Where can I buy UPCMLD0ENAT5260587:001?
You can request a quote for UPCMLD0ENAT5260587:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5260587:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5260587:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.