![5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one structure](/static/products/839/839686-36-1.png)
5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
TL;DR: 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one (CAS 839686-36-1) is a chemical compound with molecular formula C20H20BrN5O4 and molecular weight 473.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(2-bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
Also Known As: 5-[4-(2-bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one, 5-{4-[(2-bromophenyl)carbonyl]piperazin-1-yl}-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one, 6-[4-(2-bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-5-nitro-benzoimidazol-2-one, 5-[4-(2-bromobenzoyl)-1-piperazinyl]-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one
| Molecular Formula | C20H20BrN5O4 |
|---|---|
| Molecular Weight | 473.07 g/mol |
| LogP | 2.5101 |
| Topological Polar Surface Area | 93.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 473.0699 |
| Heavy Atoms | 30 |
| Complexity | 1223.8953 |
Chemical Identifiers
| CAS Number | 839686-36-1 |
|---|---|
| SMILES | CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CC=C4Br |
Product Overview
5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one (CAS 839686-36-1), with molecular formula C20H20BrN5O4 and molecular weight 473.07 g/mol. IUPAC: 5-[4-(2-bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one.
Chemical Property Profile of 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
Property Insights of 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
The XLogP value of 2.5101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one. The TPSA of 93.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one. Following Lipinski's Rule of Five, 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one has 0 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 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
The CAS number of 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one is 839686-36-1.
What is the molecular formula of 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
The molecular formula of 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one is C20H20BrN5O4.
What is the molecular weight of 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
The molecular weight of 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one is 473.07 g/mol.
Where can I buy 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
You can request a quote for 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-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-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[4-(2-Bromobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.