BAS 00126995
TL;DR: BAS 00126995 (CAS 301655-84-5) is a chemical compound with molecular formula C23H18O7 and molecular weight 406.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(2-methylphenyl)-1',3'-dioxospiro[2H-furan-5,2'-indene]-3,4-dicarboxylate
Also Known As: BAS 00126995, BIM-0016457.P001, dimethyl 5-(2-methylphenyl)-1',3'-dioxo-1',3'-dihydro-5H-spiro[furan-2,2'-indene]-3,4-dicarboxylate, dimethyl 2-(2-methylphenyl)-1',3'-dioxospiro[2H-furan-5,2'-indene]-3,4-dicarboxylate, 3,4-DIMETHYL 5-(2-METHYLPHENYL)-1',3'-DIOXO-1',3'-DIHYDRO-5H-SPIRO[FURAN-2,2'-INDENE]-3,4-DICARBOXYLATE
| Molecular Formula | C23H18O7 |
|---|---|
| Molecular Weight | 406.11 g/mol |
| LogP | 2.52692 |
| Topological Polar Surface Area | 95.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.10526 |
| Heavy Atoms | 30 |
| Complexity | 1106.7456 |
Chemical Identifiers
| CAS Number | 301655-84-5 |
|---|---|
| SMILES | CC1=CC=CC=C1C2C(=C(C3(O2)C(=O)C4=CC=CC=C4C3=O)C(=O)OC)C(=O)OC |
Product Overview
BAS 00126995 (CAS 301655-84-5), with molecular formula C23H18O7 and molecular weight 406.11 g/mol. IUPAC: dimethyl 2-(2-methylphenyl)-1',3'-dioxospiro[2H-furan-5,2'-indene]-3,4-dicarboxylate.
Chemical Property Profile of BAS 00126995
Property Insights of BAS 00126995
The XLogP value of 2.52692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00126995. The TPSA of 95.97 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00126995. Following Lipinski's Rule of Five, BAS 00126995 has 0 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 00126995?
The CAS number of BAS 00126995 is 301655-84-5.
What is the molecular formula of BAS 00126995?
The molecular formula of BAS 00126995 is C23H18O7.
What is the molecular weight of BAS 00126995?
The molecular weight of BAS 00126995 is 406.11 g/mol.
Where can I buy BAS 00126995?
You can request a quote for BAS 00126995 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00126995?
Yes, KEHONG BIO provides custom synthesis services for BAS 00126995 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.