![1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one structure](/static/products/797/797770-13-9.png)
1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one
TL;DR: 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one (CAS 797770-13-9) is a chemical compound with molecular formula C22H25N5O4 and molecular weight 423.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one
Also Known As: BAS 08315319, 1,3-Dihydro-1,3-dimethyl-5-nitro-6-[4-(1-oxo-3-phenylpropyl)-1-piperazinyl]-2H-benzimidazol-2-one, 1,3-dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)-1-piperazinyl]-1,3-dihydro-2H-benzimidazol-2-one, 1,3-dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one, 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]-1,3-dihydro-2H-benzimidazol-2-one
| Molecular Formula | C22H25N5O4 |
|---|---|
| Molecular Weight | 423.19 g/mol |
| LogP | 2.0666 |
| Topological Polar Surface Area | 93.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.19064 |
| Heavy Atoms | 31 |
| Complexity | 1190.0719 |
Chemical Identifiers
| CAS Number | 797770-13-9 |
|---|---|
| SMILES | CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)C(=O)CCC4=CC=CC=C4 |
Product Overview
1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one (CAS 797770-13-9), with molecular formula C22H25N5O4 and molecular weight 423.19 g/mol. IUPAC: 1,3-dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one.
Chemical Property Profile of 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one
Property Insights of 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one
The XLogP value of 2.0666 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one. The TPSA of 93.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one. Following Lipinski's Rule of Five, 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-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 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one?
The CAS number of 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one is 797770-13-9.
What is the molecular formula of 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one?
The molecular formula of 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one is C22H25N5O4.
What is the molecular weight of 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one?
The molecular weight of 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one is 423.19 g/mol.
Where can I buy 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one?
You can request a quote for 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]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 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl-5-nitro-6-[4-(3-phenylpropanoyl)piperazin-1-yl]benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.