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Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate
TL;DR: Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate (CAS 42784-25-8) is a chemical compound with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-aminobenzimidazole-1-carboxylate
Also Known As: methyl 2-aminobenzimidazole-1-carboxylate, Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate, 2-amino-1-(methoxycarbonyl)benzimidazole, Methyl 2-aminobenzoimidazole-1-carboxylate, 1H-Benzimidazole-1-carboxylic acid, 2-amino-, meth
| Molecular Formula | C9H9N3O2 |
|---|---|
| Molecular Weight | 191.07 g/mol |
| LogP | 1.233 |
| Topological Polar Surface Area | 70.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.06947 |
| Heavy Atoms | 14 |
| Complexity | 489.76276 |
Chemical Identifiers
| CAS Number | 42784-25-8 |
|---|---|
| SMILES | COC(=O)N1C2=CC=CC=C2N=C1N |
Product Overview
Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate (CAS 42784-25-8), with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol. IUPAC: methyl 2-aminobenzimidazole-1-carboxylate.
Chemical Property Profile of Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate
Property Insights of Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate
The XLogP value of 1.233 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate. The TPSA of 70.14 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate. Following Lipinski's Rule of Five, Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate has 1 hydrogen bond donor(s) and 4 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-amino-1H-benzo[d]imidazole-1-carboxylate?
The CAS number of Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate is 42784-25-8.
What is the molecular formula of Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate?
The molecular formula of Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate is C9H9N3O2.
What is the molecular weight of Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate?
The molecular weight of Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate is 191.07 g/mol.
Where can I buy Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate?
You can request a quote for Methyl 2-amino-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 Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-amino-1H-benzo[d]imidazole-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.