BAS 06612609
TL;DR: BAS 06612609 (CAS 799258-23-4) is a chemical compound with molecular formula C20H26N2O4S and molecular weight 390.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-3-(2-methylbutan-2-yl)-2-oxooxolane-3-carboxylate
Also Known As: BAS 06612609, ethyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-3-(2-methylbutan-2-yl)-2-oxooxolane-3-carboxylate, Pentonic acid, 5-S-1H-benzimidazol-2-yl-2,3-dideoxy-2-(1,1-dimethylpropyl)-2-(ethoxycarbonyl)-5-thio-, gamma-lactone, Pentonic acid, 5-S-1H-benzimidazol-2-yl-2,3-dideoxy-2-(1,1-dimethylpropyl)-2-(ethoxycarbonyl)-5-thio-, I(3)-lactone
| Molecular Formula | C20H26N2O4S |
|---|---|
| Molecular Weight | 390.16 g/mol |
| LogP | 3.9562 |
| Topological Polar Surface Area | 81.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.16132 |
| Heavy Atoms | 27 |
| Complexity | 814.3742 |
Chemical Identifiers
| CAS Number | 799258-23-4 |
|---|---|
| SMILES | CCC(C)(C)C1(CC(OC1=O)CSC2=NC3=CC=CC=C3N2)C(=O)OCC |
Product Overview
BAS 06612609 (CAS 799258-23-4), with molecular formula C20H26N2O4S and molecular weight 390.16 g/mol. IUPAC: ethyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-3-(2-methylbutan-2-yl)-2-oxooxolane-3-carboxylate.
Chemical Property Profile of BAS 06612609
Property Insights of BAS 06612609
The XLogP value of 3.9562 indicates that BAS 06612609 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.28 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06612609. Following Lipinski's Rule of Five, BAS 06612609 has 1 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 06612609?
The CAS number of BAS 06612609 is 799258-23-4.
What is the molecular formula of BAS 06612609?
The molecular formula of BAS 06612609 is C20H26N2O4S.
What is the molecular weight of BAS 06612609?
The molecular weight of BAS 06612609 is 390.16 g/mol.
Where can I buy BAS 06612609?
You can request a quote for BAS 06612609 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06612609?
Yes, KEHONG BIO provides custom synthesis services for BAS 06612609 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.