BAS 00125537
TL;DR: BAS 00125537 (CAS 301327-03-7) is a chemical compound with molecular formula C32H34O6 and molecular weight 514.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[1-(4-acetyloxy-2-methyl-5-propan-2-ylphenyl)-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] acetate
Also Known As: BAS 00125537, J3.787.722K, [4-[1-(4-acetyloxy-2-methyl-5-propan-2-ylphenyl)-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] acetate, (3-oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(2-isopropyl-5-methyl-4,1-phenylene) diacetate, 4-{1-[4-(acetyloxy)-5-isopropyl-2-methylphenyl]-3-oxo-1,3-dihydro-2-benzofuran-1-yl}-2-isopropyl-5-methylphenyl acetate
| Molecular Formula | C32H34O6 |
|---|---|
| Molecular Weight | 514.24 g/mol |
| LogP | 6.86314 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 514.23553 |
| Heavy Atoms | 38 |
| Complexity | 1369.0441 |
Chemical Identifiers
| CAS Number | 301327-03-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)OC(=O)C)C(C)C)C(C)C)OC(=O)C |
Product Overview
BAS 00125537 (CAS 301327-03-7), with molecular formula C32H34O6 and molecular weight 514.24 g/mol. IUPAC: [4-[1-(4-acetyloxy-2-methyl-5-propan-2-ylphenyl)-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] acetate.
Chemical Property Profile of BAS 00125537
Property Insights of BAS 00125537
The XLogP value of 6.86314 indicates that BAS 00125537 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00125537. Following Lipinski's Rule of Five, BAS 00125537 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00125537?
The CAS number of BAS 00125537 is 301327-03-7.
What is the molecular formula of BAS 00125537?
The molecular formula of BAS 00125537 is C32H34O6.
What is the molecular weight of BAS 00125537?
The molecular weight of BAS 00125537 is 514.24 g/mol.
Where can I buy BAS 00125537?
You can request a quote for BAS 00125537 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00125537?
Yes, KEHONG BIO provides custom synthesis services for BAS 00125537 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.