BAS 04058470
TL;DR: BAS 04058470 (CAS 440087-46-7) is a chemical compound with molecular formula C20H20N2O6 and molecular weight 384.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxoacetyl]amino]benzoate
Also Known As: BAS 04058470, ethyl 4-[[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxoacetyl]amino]benzoate, ethyl 4-({[(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)amino](oxo)acetyl}amino)benzoate, ethyl 4-(2-(((2,3-dihydrobenzo[b][1,4]dioxin-2-yl)methyl)amino)-2-oxoacetamido)benzoate
| Molecular Formula | C20H20N2O6 |
|---|---|
| Molecular Weight | 384.13 g/mol |
| LogP | 1.758 |
| Topological Polar Surface Area | 102.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 384.13214 |
| Heavy Atoms | 28 |
| Complexity | 865.2546 |
Chemical Identifiers
| CAS Number | 440087-46-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2COC3=CC=CC=C3O2 |
Product Overview
BAS 04058470 (CAS 440087-46-7), with molecular formula C20H20N2O6 and molecular weight 384.13 g/mol. IUPAC: ethyl 4-[[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxoacetyl]amino]benzoate.
Chemical Property Profile of BAS 04058470
Property Insights of BAS 04058470
The XLogP value of 1.758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04058470. The TPSA of 102.96 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04058470. Following Lipinski's Rule of Five, BAS 04058470 has 2 hydrogen bond donor(s) and 6 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 04058470?
The CAS number of BAS 04058470 is 440087-46-7.
What is the molecular formula of BAS 04058470?
The molecular formula of BAS 04058470 is C20H20N2O6.
What is the molecular weight of BAS 04058470?
The molecular weight of BAS 04058470 is 384.13 g/mol.
Where can I buy BAS 04058470?
You can request a quote for BAS 04058470 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04058470?
Yes, KEHONG BIO provides custom synthesis services for BAS 04058470 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.