BAS 03570858
TL;DR: BAS 03570858 (CAS 307541-57-7) is a chemical compound with molecular formula C20H17N3O3S2 and molecular weight 411.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-2-(4-propan-2-ylphenyl)-1-(1,3,4-thiadiazol-2-yl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: BAS 03570858, AB00286859-02, 3-hydroxy-5-[4-(propan-2-yl)phenyl]-1-(1,3,4-thiadiazol-2-yl)-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, 3-HYDROXY-5-(4-ISOPROPYLPHENYL)-1-(1,3,4-THIADIAZOL-2-YL)-4-(2-THIENYLCARBONYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 3-hydroxy-5-(4-isopropylphenyl)-1-(1,3,4-thiadiazol-2-yl)-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C20H17N3O3S2 |
|---|---|
| Molecular Weight | 411.07 g/mol |
| LogP | 4.5059 |
| Topological Polar Surface Area | 83.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.07114 |
| Heavy Atoms | 28 |
| Complexity | 1039.0785 |
Chemical Identifiers
| CAS Number | 307541-57-7 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NN=CS3)O)C(=O)C4=CC=CS4 |
Product Overview
BAS 03570858 (CAS 307541-57-7), with molecular formula C20H17N3O3S2 and molecular weight 411.07 g/mol. IUPAC: 4-hydroxy-2-(4-propan-2-ylphenyl)-1-(1,3,4-thiadiazol-2-yl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of BAS 03570858
Property Insights of BAS 03570858
The XLogP value of 4.5059 indicates that BAS 03570858 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03570858. Following Lipinski's Rule of Five, BAS 03570858 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 BAS 03570858?
The CAS number of BAS 03570858 is 307541-57-7.
What is the molecular formula of BAS 03570858?
The molecular formula of BAS 03570858 is C20H17N3O3S2.
What is the molecular weight of BAS 03570858?
The molecular weight of BAS 03570858 is 411.07 g/mol.
Where can I buy BAS 03570858?
You can request a quote for BAS 03570858 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03570858?
Yes, KEHONG BIO provides custom synthesis services for BAS 03570858 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.