5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
TL;DR: 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one (CAS 24786-50-3) is a chemical compound with molecular formula C9H10N4O3 and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1,3-dimethyl-6-nitrobenzimidazol-2-one
Also Known As: 5-amino-1,3-dimethyl-6-nitrobenzimidazol-2-one, 5-Amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzo[d]imidazol-2-one, BB 0217072, 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one, 5-amino-1,3-dimethyl-6-nitro-2,3-dihydro-1H-1,3-benzodiazol-2-one
| Molecular Formula | C9H10N4O3 |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 0.3674 |
| Topological Polar Surface Area | 96.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.07529 |
| Heavy Atoms | 16 |
| Complexity | 652.79834 |
Chemical Identifiers
| CAS Number | 24786-50-3 |
|---|---|
| SMILES | CN1C2=C(C=C(C(=C2)N)[N+](=O)[O-])N(C1=O)C |
Product Overview
5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one (CAS 24786-50-3), with molecular formula C9H10N4O3 and molecular weight 222.08 g/mol. IUPAC: 5-amino-1,3-dimethyl-6-nitrobenzimidazol-2-one.
Chemical Property Profile of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
Property Insights of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
The XLogP value of 0.3674 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one. The TPSA of 96.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one. Following Lipinski's Rule of Five, 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one 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
Frequently Asked Questions
What is the CAS number of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one?
The CAS number of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one is 24786-50-3.
What is the molecular formula of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one?
The molecular formula of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one is C9H10N4O3.
What is the molecular weight of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one?
The molecular weight of 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one is 222.08 g/mol.
Where can I buy 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one?
You can request a quote for 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.