BAS 00126974
TL;DR: BAS 00126974 (CAS 300690-49-7) is a chemical compound with molecular formula C33H21BrO5 and molecular weight 576.05725 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Also Known As: BAS 00126974, BIM-0016580.P001, 3'-(4-BROMOPHENYL)-5'-(4-METHYLPHENYL)-1,1'',3,3''-TETRAHYDRODISPIRO[INDENE-2,2'-OXOLANE-4',2''-INDENE]-1,1'',3,3''-TETRONE, 3'-(4-bromophenyl)-5'-(4-methylphenyl)dispiro[indene-2,2'-furan-4',2''-indene]-1,1'',3,3''-tetrone, 3-(4-bromophenyl)-5-(4-methylphenyl)dispiro[indene-2,2-furan-4,2-indene]-1,1,3,3-tetrone
Technical Specifications
| Molecular Formula | C33H21BrO5 |
| Molecular Weight | 576.05725 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 77.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 576.05725 Da |
| Heavy Atoms | 39 |
| Complexity | 1000.0 |
| SMILES | CC1=CC=C(C=C1)C2C3(C(C4(O2)C(=O)C5=CC=CC=C5C4=O)C6=CC=C(C=C6)Br)C(=O)C7=CC=CC=C7C3=O |
| InChIKey | DYSFWEHRGXUQFL-UHFFFAOYSA-N |
Chemical Property Profile of BAS 00126974
Property Insights of BAS 00126974
The XLogP value of 6.3 indicates that BAS 00126974 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00126974. Following Lipinski's Rule of Five, BAS 00126974 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of BAS 00126974?
The CAS number of BAS 00126974 is 300690-49-7.
What is the molecular formula of BAS 00126974?
The molecular formula of BAS 00126974 is C33H21BrO5.
What is the molecular weight of BAS 00126974?
The molecular weight of BAS 00126974 is 576.05725 g/mol.
Where can I buy BAS 00126974?
You can request a quote for BAS 00126974 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 00126974?
Yes, CoreyChem provides custom synthesis services for BAS 00126974 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.