5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole
TL;DR: 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole (CAS 637745-31-4) is a chemical compound with molecular formula C18H20N2O and molecular weight 280.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethyl-1-(3-phenoxypropyl)benzimidazole
Also Known As: BAS 07327770, 5,6-dimethyl-1-(3-phenoxypropyl)benzimidazole, UPCMLD0ENAT5445740:001, 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole, [3-(5,6-dimethylbenzimidazolyl)propoxy]benzene
| Molecular Formula | C18H20N2O |
|---|---|
| Molecular Weight | 280.16 g/mol |
| LogP | 4.12224 |
| Topological Polar Surface Area | 27.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.15756 |
| Heavy Atoms | 21 |
| Complexity | 731.56305 |
Chemical Identifiers
| CAS Number | 637745-31-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C=N2)CCCOC3=CC=CC=C3 |
Product Overview
5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole (CAS 637745-31-4), with molecular formula C18H20N2O and molecular weight 280.16 g/mol. IUPAC: 5,6-dimethyl-1-(3-phenoxypropyl)benzimidazole.
Chemical Property Profile of 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole
Property Insights of 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole
The XLogP value of 4.12224 indicates that 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.05 Ų, 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole has 0 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 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole?
The CAS number of 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole is 637745-31-4.
What is the molecular formula of 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole?
The molecular formula of 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole is C18H20N2O.
What is the molecular weight of 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole?
The molecular weight of 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole is 280.16 g/mol.
Where can I buy 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole?
You can request a quote for 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 5,6-dimethyl-1-(3-phenoxypropyl)-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.