![5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one structure](/static/products/6972/697240-81-6.webp)
5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
TL;DR: 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one (CAS 697240-81-6) is a chemical compound with molecular formula C20H20FN5O4 and molecular weight 413.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(4-fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
Also Known As: AB00356245-07, A3638/0154373, 5-[4-(4-fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one, 5-[4-(4-fluorobenzoyl)-1-piperazinyl]-1,3-dimethyl-6-nitro-1,3-dihydro-2H-benzimidazol-2-one, 5-[4-(4-FLUOROBENZOYL)PIPERAZIN-1-YL]-1,3-DIMETHYL-6-NITRO-2,3-DIHYDRO-1H-1,3-BENZODIAZOL-2-ONE
| Molecular Formula | C20H20FN5O4 |
|---|---|
| Molecular Weight | 413.15 g/mol |
| LogP | 1.8867 |
| Topological Polar Surface Area | 93.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.14993 |
| Heavy Atoms | 30 |
| Complexity | 1206.6453 |
Chemical Identifiers
| CAS Number | 697240-81-6 |
|---|---|
| SMILES | CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=C(C=C4)F |
Product Overview
5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one (CAS 697240-81-6), with molecular formula C20H20FN5O4 and molecular weight 413.15 g/mol. IUPAC: 5-[4-(4-fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one.
Chemical Property Profile of 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
Property Insights of 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one
The XLogP value of 1.8867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[4-(4-Fluorobenzoyl)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-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one. Following Lipinski's Rule of Five, 5-[4-(4-Fluorobenzoyl)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-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
The CAS number of 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one is 697240-81-6.
What is the molecular formula of 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
The molecular formula of 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one is C20H20FN5O4.
What is the molecular weight of 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
The molecular weight of 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one is 413.15 g/mol.
Where can I buy 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
You can request a quote for 5-[4-(4-Fluorobenzoyl)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-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-[4-(4-Fluorobenzoyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.