RefChem:530200
TL;DR: RefChem:530200 (CAS 432019-45-9) is a chemical compound with molecular formula C18H12BrN3O4S and molecular weight 444.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-pyrrol-5-one
Also Known As: 5-(4-bromophenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one, 2-(4-bromophenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-pyrrol-5-one, 5-(4-bromophenyl)-4-(2-furoyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one, 5-(4-bromophenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-one, 5-(4-bromophenyl)-4-(furan-2-ylcarbonyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C18H12BrN3O4S |
|---|---|
| Molecular Weight | 444.97 g/mol |
| LogP | 3.98492 |
| Topological Polar Surface Area | 96.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.97318 |
| Heavy Atoms | 27 |
| Complexity | 1056.7345 |
Chemical Identifiers
| CAS Number | 432019-45-9 |
|---|---|
| SMILES | CC1=NN=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CO3)C4=CC=C(C=C4)Br |
Product Overview
RefChem:530200 (CAS 432019-45-9), with molecular formula C18H12BrN3O4S and molecular weight 444.97 g/mol. IUPAC: 2-(4-bromophenyl)-3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2H-pyrrol-5-one.
Chemical Property Profile of RefChem:530200
Property Insights of RefChem:530200
The XLogP value of 3.98492 indicates that RefChem:530200 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.53 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:530200. Following Lipinski's Rule of Five, RefChem:530200 has 1 hydrogen bond donor(s) and 7 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:530200?
The CAS number of RefChem:530200 is 432019-45-9.
What is the molecular formula of RefChem:530200?
The molecular formula of RefChem:530200 is C18H12BrN3O4S.
What is the molecular weight of RefChem:530200?
The molecular weight of RefChem:530200 is 444.97 g/mol.
Where can I buy RefChem:530200?
You can request a quote for RefChem:530200 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:530200?
Yes, KEHONG BIO provides custom synthesis services for RefChem:530200 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.