RefChem:239363
TL;DR: RefChem:239363 (CAS 115398-83-9) is a chemical compound with molecular formula C28H25N5O4 and molecular weight 495.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-2-[[1-[(4-phenylpiperidin-1-yl)methyl]benzimidazol-2-yl]methyl]isoindole-1,3-dione
Also Known As: 1H-Isoindole-1,3(2H)-dione, 5-nitro-2-((1-((4-phenyl-1-piperdinyl)methyl)-1H-benzimidazol-2-yl)methyl)-, 5-nitro-2-[[1-[(4-phenyl-1-piperidyl)methyl]benzoimidazol-2-yl]methyl]isoindole-1,3-dione, 5-nitro-2-[[1-[(4-phenylpiperidin-1-yl)methyl]benzimidazol-2-yl]methyl]isoindole-1,3-dione, 5-Nitro-2-({1-[(4-phenylpiperidin-1-yl)methyl]-1H-1,3-benzimidazol-2-yl}methyl)-1H-isoindole-1,3(2H)-dione, RefChem:239363
| Molecular Formula | C28H25N5O4 |
|---|---|
| Molecular Weight | 495.19 g/mol |
| LogP | 4.5778 |
| Topological Polar Surface Area | 101.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.19064 |
| Heavy Atoms | 37 |
| Complexity | 1522.3746 |
Chemical Identifiers
| CAS Number | 115398-83-9 |
|---|---|
| SMILES | C1CN(CCC1C2=CC=CC=C2)CN3C4=CC=CC=C4N=C3CN5C(=O)C6=C(C5=O)C=C(C=C6)[N+](=O)[O-] |
Product Overview
RefChem:239363 (CAS 115398-83-9), with molecular formula C28H25N5O4 and molecular weight 495.19 g/mol. IUPAC: 5-nitro-2-[[1-[(4-phenylpiperidin-1-yl)methyl]benzimidazol-2-yl]methyl]isoindole-1,3-dione.
Chemical Property Profile of RefChem:239363
Property Insights of RefChem:239363
The XLogP value of 4.5778 indicates that RefChem:239363 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.58 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:239363. Following Lipinski's Rule of Five, RefChem:239363 has 0 hydrogen bond donor(s) and 6 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 RefChem:239363?
The CAS number of RefChem:239363 is 115398-83-9.
What is the molecular formula of RefChem:239363?
The molecular formula of RefChem:239363 is C28H25N5O4.
What is the molecular weight of RefChem:239363?
The molecular weight of RefChem:239363 is 495.19 g/mol.
Where can I buy RefChem:239363?
You can request a quote for RefChem:239363 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:239363?
Yes, KEHONG BIO provides custom synthesis services for RefChem:239363 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.