diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate
TL;DR: diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate (CAS 83330-80-7) is a chemical compound with molecular formula C15H18N2O5 and molecular weight 306.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2-oxobenzimidazol-1-yl]acetate
Also Known As: ChemDiv2_002001, diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate, BAS 00282069, ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2-oxobenzimidazol-1-yl]acetate, A2175/0091348
| Molecular Formula | C15H18N2O5 |
|---|---|
| Molecular Weight | 306.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 306.12158 |
| Heavy Atoms | 22 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 83330-80-7 |
|---|---|
| SMILES | CCOC(=O)CN1C2=CC=CC=C2N(C1=O)CC(=O)OCC |
| InChIKey | ZNFJQMSFNGBHEJ-UHFFFAOYSA-N |
Product Overview
diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate (CAS 83330-80-7), with molecular formula C15H18N2O5 and molecular weight 306.12 g/mol. IUPAC: ethyl 2-[3-(2-ethoxy-2-oxoethyl)-2-oxobenzimidazol-1-yl]acetate.
Chemical Property Profile of diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate
Property Insights of diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate. Following Lipinski's Rule of Five, diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate has 0 hydrogen bond donor(s) and 5 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 diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate?
The CAS number of diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate is 83330-80-7.
What is the molecular formula of diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate?
The molecular formula of diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate is C15H18N2O5.
What is the molecular weight of diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate?
The molecular weight of diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate is 306.12 g/mol.
Where can I buy diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate?
You can request a quote for diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate?
Yes, KEHONG BIO provides custom synthesis services for diethyl 2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.