BAS 05887250
TL;DR: BAS 05887250 (CAS 608114-47-2) is a chemical compound with molecular formula C21H14N2O4S2 and molecular weight 422.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(furan-2-carbonyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-2H-pyrrol-5-one
Also Known As: BAS 05887250, 4-(2-furylcarbonyl)-3-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-one, 3-(furan-2-carbonyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-2H-pyrrol-5-one, 4-(furan-2-ylcarbonyl)-3-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C21H14N2O4S2 |
|---|---|
| Molecular Weight | 422.04 g/mol |
| LogP | 5.04212 |
| Topological Polar Surface Area | 83.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.0395 |
| Heavy Atoms | 29 |
| Complexity | 1269.5078 |
Chemical Identifiers
| CAS Number | 608114-47-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CO4)C5=CC=CS5 |
Product Overview
BAS 05887250 (CAS 608114-47-2), with molecular formula C21H14N2O4S2 and molecular weight 422.04 g/mol. IUPAC: 3-(furan-2-carbonyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-2-thiophen-2-yl-2H-pyrrol-5-one.
Chemical Property Profile of BAS 05887250
Property Insights of BAS 05887250
The XLogP value of 5.04212 indicates that BAS 05887250 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.64 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05887250. Following Lipinski's Rule of Five, BAS 05887250 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 BAS 05887250?
The CAS number of BAS 05887250 is 608114-47-2.
What is the molecular formula of BAS 05887250?
The molecular formula of BAS 05887250 is C21H14N2O4S2.
What is the molecular weight of BAS 05887250?
The molecular weight of BAS 05887250 is 422.04 g/mol.
Where can I buy BAS 05887250?
You can request a quote for BAS 05887250 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05887250?
Yes, KEHONG BIO provides custom synthesis services for BAS 05887250 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.