Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester
TL;DR: Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester (CAS 42784-13-4) is a chemical compound with molecular formula C17H15N3O4 and molecular weight 325.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[1-(2-phenoxyacetyl)benzimidazol-2-yl]carbamate
Also Known As: Benacyl, benacil, 1-Phenoxyacetyl-2-carbomethoxyaminobenzimidazole, 5-25-10-00406 (Beilstein Handbook Reference), methyl N-[1-(2-phenoxyacetyl)benzimidazol-2-yl]carbamate
| Molecular Formula | C17H15N3O4 |
|---|---|
| Molecular Weight | 325.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.10626 |
| Heavy Atoms | 24 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 42784-13-4 |
|---|---|
| SMILES | COC(=O)NC1=NC2=CC=CC=C2N1C(=O)COC3=CC=CC=C3 |
| InChIKey | BHWHSIBHVBDSRN-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester (CAS 42784-13-4), with molecular formula C17H15N3O4 and molecular weight 325.11 g/mol. IUPAC: methyl N-[1-(2-phenoxyacetyl)benzimidazol-2-yl]carbamate.
Chemical Property Profile of Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester
Property Insights of Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester. Following Lipinski's Rule of Five, Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester has 1 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 Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester?
The CAS number of Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester is 42784-13-4.
What is the molecular formula of Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester?
The molecular formula of Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester is C17H15N3O4.
What is the molecular weight of Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester?
The molecular weight of Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester is 325.11 g/mol.
Where can I buy Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester?
You can request a quote for Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (1-(phenoxyacetyl)-1H-benzimidazol-2-yl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.