BAS 02729668
TL;DR: BAS 02729668 (CAS 335209-26-2) is a chemical compound with molecular formula C23H22N2O7S and molecular weight 470.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[2-(2,3-dioxoindol-1-yl)acetyl]oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: BAS 02729668, ethyl 2-[({[(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetyl]oxy}acetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(2-(2-(2,3-dioxoindolin-1-yl)acetoxy)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ETHYL 2-(2-{[2-(2,3-DIOXO-2,3-DIHYDRO-1H-INDOL-1-YL)ACETYL]OXY}ACETAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, ethyl 2-[[2-[2-(2,3-dioxoindol-1-yl)acetyl]oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C23H22N2O7S |
|---|---|
| Molecular Weight | 470.11 g/mol |
| LogP | 2.5148 |
| Topological Polar Surface Area | 119.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.11478 |
| Heavy Atoms | 33 |
| Complexity | 1153.6738 |
Chemical Identifiers
| CAS Number | 335209-26-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)CN3C4=CC=CC=C4C(=O)C3=O |
Product Overview
BAS 02729668 (CAS 335209-26-2), with molecular formula C23H22N2O7S and molecular weight 470.11 g/mol. IUPAC: ethyl 2-[[2-[2-(2,3-dioxoindol-1-yl)acetyl]oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of BAS 02729668
Property Insights of BAS 02729668
The XLogP value of 2.5148 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02729668. The TPSA of 119.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02729668. Following Lipinski's Rule of Five, BAS 02729668 has 1 hydrogen bond donor(s) and 8 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 02729668?
The CAS number of BAS 02729668 is 335209-26-2.
What is the molecular formula of BAS 02729668?
The molecular formula of BAS 02729668 is C23H22N2O7S.
What is the molecular weight of BAS 02729668?
The molecular weight of BAS 02729668 is 470.11 g/mol.
Where can I buy BAS 02729668?
You can request a quote for BAS 02729668 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02729668?
Yes, KEHONG BIO provides custom synthesis services for BAS 02729668 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.