2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-
TL;DR: 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- (CAS 54833-62-4) is a chemical compound with molecular formula C16H15N3O3 and molecular weight 297.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5,6-dimethyl-2H-benzimidazol-2-yl)-(3-nitrophenyl)methanol
Also Known As: 5,6-Dimethyl-alpha-(3-nitrophenyl)-2H-benzimidazole-2-methanol, 2H-Benzimidazole-2-methanol, 5,6-dimethyl-.alpha.-(3-nitrophenyl)-, (5,6-Dimethyl-2H-benzimidazol-2-yl)(3-nitrophenyl)methanol, (5,6-Dimethyl-2H-benzimidazol-2-yl)(3-nitrophenyl)methanol #, (5,6-dimethyl-2H-benzimidazol-2-yl)-(3-nitrophenyl)methanol
| Molecular Formula | C16H15N3O3 |
|---|---|
| Molecular Weight | 297.11 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 90.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.11133 |
| Heavy Atoms | 22 |
| Complexity | 579.0 |
Chemical Identifiers
| CAS Number | 54833-62-4 |
|---|---|
| SMILES | CC1=CC2=NC(N=C2C=C1C)C(C3=CC(=CC=C3)[N+](=O)[O-])O |
| InChIKey | GFWGCIBCLHZTRR-UHFFFAOYSA-N |
Product Overview
2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- (CAS 54833-62-4), with molecular formula C16H15N3O3 and molecular weight 297.11 g/mol. IUPAC: (5,6-dimethyl-2H-benzimidazol-2-yl)-(3-nitrophenyl)methanol.
Chemical Property Profile of 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-
Property Insights of 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-. The TPSA of 90.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-. Following Lipinski's Rule of Five, 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- has 1 hydrogen bond donor(s) and 5 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 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-?
The CAS number of 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- is 54833-62-4.
What is the molecular formula of 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-?
The molecular formula of 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- is C16H15N3O3.
What is the molecular weight of 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-?
The molecular weight of 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- is 297.11 g/mol.
Where can I buy 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-?
You can request a quote for 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Benzimidazole-2-methanol, 5,6-dimethyl-alpha-(3-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.