BAS 00874080
TL;DR: BAS 00874080 (CAS 332056-20-9) is a chemical compound with molecular formula C24H26O12 and molecular weight 506.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[1-(1,3-diethoxy-1,3-dioxopropan-2-yl)-3,7-dioxo-1,5-dihydrofuro[3,4-f][2]benzofuran-5-yl]propanedioate
Also Known As: BAS 00874080, BIM-0007704.P001, tetraethyl 2,2'-(3,7-dioxo-1,3,5,7-tetrahydrobenzo[1,2-c:4,5-c']difuran-1,5-diyl)dimalonate, diethyl 2-[1-(1,3-diethoxy-1,3-dioxopropan-2-yl)-3,7-dioxo-1,5-dihydrofuro[3,4-f][2]benzofuran-5-yl]propanedioate, DIETHYL 2-{5-[2-ETHOXY-1-(ETHOXYCARBONYL)-2-OXOETHYL]-3,7-DIOXO-5,7-DIHYDRO-1H,3H-FURO[3,4-F]ISOBENZOFURAN-1-YL}MALONATE
| Molecular Formula | C24H26O12 |
|---|---|
| Molecular Weight | 506.14 g/mol |
| LogP | 1.5944 |
| Topological Polar Surface Area | 157.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 506.14243 |
| Heavy Atoms | 36 |
| Complexity | 969.06305 |
Chemical Identifiers
| CAS Number | 332056-20-9 |
|---|---|
| SMILES | CCOC(=O)C(C1C2=CC3=C(C=C2C(=O)O1)C(OC3=O)C(C(=O)OCC)C(=O)OCC)C(=O)OCC |
Product Overview
BAS 00874080 (CAS 332056-20-9), with molecular formula C24H26O12 and molecular weight 506.14 g/mol. IUPAC: diethyl 2-[1-(1,3-diethoxy-1,3-dioxopropan-2-yl)-3,7-dioxo-1,5-dihydrofuro[3,4-f][2]benzofuran-5-yl]propanedioate.
Chemical Property Profile of BAS 00874080
Property Insights of BAS 00874080
The XLogP value of 1.5944 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00874080. The TPSA of 157.8 Ų indicates high polarity, suggesting BAS 00874080 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 00874080 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00874080?
The CAS number of BAS 00874080 is 332056-20-9.
What is the molecular formula of BAS 00874080?
The molecular formula of BAS 00874080 is C24H26O12.
What is the molecular weight of BAS 00874080?
The molecular weight of BAS 00874080 is 506.14 g/mol.
Where can I buy BAS 00874080?
You can request a quote for BAS 00874080 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00874080?
Yes, KEHONG BIO provides custom synthesis services for BAS 00874080 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.