1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole
TL;DR: 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole (CAS 6112-29-4) is a chemical compound with molecular formula C20H22N2O and molecular weight 306.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-tert-butylphenyl)-(5,6-dimethylbenzimidazol-1-yl)methanone
Also Known As: 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole, (4-tert-butylphenyl)-(5,6-dimethylbenzimidazol-1-yl)methanone
| Molecular Formula | C20H22N2O |
|---|---|
| Molecular Weight | 306.17 g/mol |
| LogP | 4.63914 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.17322 |
| Heavy Atoms | 23 |
| Complexity | 880.3859 |
Chemical Identifiers
| CAS Number | 6112-29-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C=N2)C(=O)C3=CC=C(C=C3)C(C)(C)C |
Product Overview
1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole (CAS 6112-29-4), with molecular formula C20H22N2O and molecular weight 306.17 g/mol. IUPAC: (4-tert-butylphenyl)-(5,6-dimethylbenzimidazol-1-yl)methanone.
Chemical Property Profile of 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole
Property Insights of 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole
The XLogP value of 4.63914 indicates that 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole 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 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole?
The CAS number of 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole is 6112-29-4.
What is the molecular formula of 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole?
The molecular formula of 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole is C20H22N2O.
What is the molecular weight of 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole?
The molecular weight of 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole is 306.17 g/mol.
Where can I buy 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole?
You can request a quote for 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-tert-butylbenzoyl)-5,6-dimethyl-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.