N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide
TL;DR: N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide (CAS 163923-47-5) is a chemical compound with molecular formula C14H15N3O3 and molecular weight 273.11133 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide
Also Known As: BAS 07339284, N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide, N-[3-(1H-imidazol-1-yl)propyl]-1,3-benzodioxole-5-carboxamide, AO-854/42320495, Benzo[1,3]dioxole-5-carboxylic acid (3-imidazol-1-yl-propyl)-amide
Technical Specifications
| Molecular Formula | C14H15N3O3 |
| Molecular Weight | 273.11133 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 65.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.11133 Da |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)NCCCN3C=CN=C3 |
| InChIKey | SNNXZVQNSGRBJU-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide
Property Insights of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide. The TPSA of 65.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide. Following Lipinski's Rule of Five, N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide 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
What is the CAS number of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide?
The CAS number of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide is 163923-47-5.
What is the molecular formula of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide is C14H15N3O3.
What is the molecular weight of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide is 273.11133 g/mol.
Where can I buy N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide?
Yes, CoreyChem provides custom synthesis services for N-(3-imidazol-1-ylpropyl)-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.