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methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate
TL;DR: methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate (CAS 314769-66-9) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(benzimidazol-1-yl)propanoate
Also Known As: methyl 2-(benzimidazol-1-yl)propanoate, methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate, AB00102312-01
| Molecular Formula | C11H12N2O2 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 1.7703 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.08987 |
| Heavy Atoms | 15 |
| Complexity | 490.04852 |
Chemical Identifiers
| CAS Number | 314769-66-9 |
|---|---|
| SMILES | CC(C(=O)OC)N1C=NC2=CC=CC=C21 |
Product Overview
methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate (CAS 314769-66-9), with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol. IUPAC: methyl 2-(benzimidazol-1-yl)propanoate.
Chemical Property Profile of methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate
Property Insights of methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate
The XLogP value of 1.7703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate. With a topological polar surface area (TPSA) of 44.12 Ų, methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate has 0 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 methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate?
The CAS number of methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate is 314769-66-9.
What is the molecular formula of methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate?
The molecular formula of methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate is C11H12N2O2.
What is the molecular weight of methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate?
The molecular weight of methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate is 204.09 g/mol.
Where can I buy methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate?
You can request a quote for methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(1H-benzo[d]imidazol-1-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.