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N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide
TL;DR: N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide (CAS 5694-60-0) is a chemical compound with molecular formula C15H19N3O and molecular weight 257.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-imidazol-1-ylpropyl)-3,4-dimethylbenzamide
Also Known As: N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide, BIM-0049018.P001, N-(3-imidazol-1-ylpropyl)-3,4-dimethylbenzamide, (3,4-dimethylphenyl)-N-(3-imidazolylpropyl)carboxamide
| Molecular Formula | C15H19N3O |
|---|---|
| Molecular Weight | 257.15 g/mol |
| LogP | 2.32004 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.1528 |
| Heavy Atoms | 19 |
| Complexity | 546.52325 |
Chemical Identifiers
| CAS Number | 5694-60-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NCCCN2C=CN=C2)C |
Product Overview
N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide (CAS 5694-60-0), with molecular formula C15H19N3O and molecular weight 257.15 g/mol. IUPAC: N-(3-imidazol-1-ylpropyl)-3,4-dimethylbenzamide.
Chemical Property Profile of N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide
Property Insights of N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide
The XLogP value of 2.32004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide. With a topological polar surface area (TPSA) of 46.92 Ų, N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide has 1 hydrogen bond donor(s) and 2 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-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide?
The CAS number of N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide is 5694-60-0.
What is the molecular formula of N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide?
The molecular formula of N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide is C15H19N3O.
What is the molecular weight of N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide?
The molecular weight of N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide is 257.15 g/mol.
Where can I buy N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide?
You can request a quote for N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(1H-imidazol-1-yl)propyl]-3,4-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.