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Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate
TL;DR: Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate (CAS 41120-23-4) is a chemical compound with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxo-3H-benzimidazole-1-carboxylate
Also Known As: ethyl 2-oxo-3H-benzimidazole-1-carboxylate, ethyl 2-oxo-2,3-dihydro-1H-1,3-benzodiazole-1-carboxylate, ETHYL 2-OXO-2,3-DIHYDRO-1H-BENZO[D]IMIDAZOLE-1-CARBOXYLATE, 1-carboethoxy-2-benzimidazolinone, ethyl 2-oxo-3h-benzo[d]imidazole-1-carboxylate
| Molecular Formula | C10H10N2O3 |
|---|---|
| Molecular Weight | 206.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.06914 |
| Heavy Atoms | 15 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 41120-23-4 |
|---|---|
| SMILES | CCOC(=O)N1C2=CC=CC=C2NC1=O |
| InChIKey | LOMOPJCGTDGQBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate (CAS 41120-23-4), with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol. IUPAC: ethyl 2-oxo-3H-benzimidazole-1-carboxylate.
Chemical Property Profile of Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate
Property Insights of Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate. With a topological polar surface area (TPSA) of 58.6 Ų, Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate has 1 hydrogen bond donor(s) and 3 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 Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate?
The CAS number of Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate is 41120-23-4.
What is the molecular formula of Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate?
The molecular formula of Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate is C10H10N2O3.
What is the molecular weight of Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate?
The molecular weight of Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate is 206.07 g/mol.
Where can I buy Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate?
You can request a quote for Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-oxo-2,3-dihydro-1H-benzo[D]imidazole-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.