BAS 00548839
TL;DR: BAS 00548839 (CAS 303216-13-9) is a chemical compound with molecular formula C38H42O10 and molecular weight 658.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-O-[4-[1-[4-(4-methoxy-4-oxobutanoyl)oxy-2-methyl-5-propan-2-ylphenyl]-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] 1-O-methyl butanedioate
Also Known As: BAS 00548839, AB01322071-02, 1-[2-isopropyl-4-(1-{5-isopropyl-4-[(4-methoxy-4-oxobutanoyl)oxy]-2-methylphenyl}-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-5-methylphenyl] 4-methyl succinate, 4-O-[4-[1-[4-(4-methoxy-4-oxobutanoyl)oxy-2-methyl-5-propan-2-ylphenyl]-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] 1-O-methyl butanedioate, 1-[2-ISOPROPYL-4-(1-{5-ISOPROPYL-4-[(4-METHOXY-4-OXOBUTANOYL)OXY]-2-METHYLPHENYL}-3-OXO-1,3-DIHYDRO-1-ISOBENZOFURANYL)-5-METHYLPHENYL] 4-METHYL SUCCINATE
| Molecular Formula | C38H42O10 |
|---|---|
| Molecular Weight | 658.28 g/mol |
| LogP | 6.72974 |
| Topological Polar Surface Area | 131.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 658.2778 |
| Heavy Atoms | 48 |
| Complexity | 1654.7804 |
Chemical Identifiers
| CAS Number | 303216-13-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)OC(=O)CCC(=O)OC)C(C)C)C(C)C)OC(=O)CCC(=O)OC |
Product Overview
BAS 00548839 (CAS 303216-13-9), with molecular formula C38H42O10 and molecular weight 658.28 g/mol. IUPAC: 4-O-[4-[1-[4-(4-methoxy-4-oxobutanoyl)oxy-2-methyl-5-propan-2-ylphenyl]-3-oxo-2-benzofuran-1-yl]-5-methyl-2-propan-2-ylphenyl] 1-O-methyl butanedioate.
Chemical Property Profile of BAS 00548839
Property Insights of BAS 00548839
The XLogP value of 6.72974 indicates that BAS 00548839 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00548839. Following Lipinski's Rule of Five, BAS 00548839 has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00548839?
The CAS number of BAS 00548839 is 303216-13-9.
What is the molecular formula of BAS 00548839?
The molecular formula of BAS 00548839 is C38H42O10.
What is the molecular weight of BAS 00548839?
The molecular weight of BAS 00548839 is 658.28 g/mol.
Where can I buy BAS 00548839?
You can request a quote for BAS 00548839 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00548839?
Yes, KEHONG BIO provides custom synthesis services for BAS 00548839 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.