N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid
TL;DR: N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid (CAS 560-97-4) is a chemical compound with molecular formula C12H15N3O3 and molecular weight 249.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,7-dimethoxy-1H-benzimidazol-2-yl)propanamide
Also Known As: N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanamide, 5-25-13-00328 (Beilstein Handbook Reference), Propanamide, N-(4,7-dimethoxy-1H-benzimidazol-2-yl)-, N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid, N-(4,7-Dimethoxy-1H-1,3-benzimidazol-2-yl)propanimidic acid
| Molecular Formula | C12H15N3O3 |
|---|---|
| Molecular Weight | 249.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.11134 |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 560-97-4 |
|---|---|
| SMILES | CCC(=O)NC1=NC2=C(C=CC(=C2N1)OC)OC |
| InChIKey | SOUVCKJJDSBWPC-UHFFFAOYSA-N |
Product Overview
N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid (CAS 560-97-4), with molecular formula C12H15N3O3 and molecular weight 249.11 g/mol. IUPAC: N-(4,7-dimethoxy-1H-benzimidazol-2-yl)propanamide.
Chemical Property Profile of N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid
Property Insights of N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid. Following Lipinski's Rule of Five, N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid has 2 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 N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid?
The CAS number of N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid is 560-97-4.
What is the molecular formula of N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid?
The molecular formula of N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid is C12H15N3O3.
What is the molecular weight of N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid?
The molecular weight of N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid is 249.11 g/mol.
Where can I buy N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid?
You can request a quote for N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(4,7-Dimethoxy-1H-benzimidazol-2-yl)propanimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.