RefChem:1090754
TL;DR: RefChem:1090754 (CAS 81217-05-2) is a chemical compound with molecular formula C28H24N4O4 and molecular weight 480.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide
Also Known As: N-Antipyrinyl-alpha-benzyl-1,3-dioxo-2-isoindolineacetamide, 2-ISOINDOLINEACETAMIDE, N-ANTIPYRINYL-alpha-BENZYL-1,3-DIOXO-, N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanamide, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide, N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanimidic acid
| Molecular Formula | C28H24N4O4 |
|---|---|
| Molecular Weight | 480.18 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 90.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.17975 |
| Heavy Atoms | 36 |
| Complexity | 910.0 |
Chemical Identifiers
| CAS Number | 81217-05-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O |
| InChIKey | HVCAHFJSEDFZHZ-UHFFFAOYSA-N |
Product Overview
RefChem:1090754 (CAS 81217-05-2), with molecular formula C28H24N4O4 and molecular weight 480.18 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide.
Chemical Property Profile of RefChem:1090754
Property Insights of RefChem:1090754
The XLogP value of 4.1 indicates that RefChem:1090754 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1090754. Following Lipinski's Rule of Five, RefChem:1090754 has 1 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 RefChem:1090754?
The CAS number of RefChem:1090754 is 81217-05-2.
What is the molecular formula of RefChem:1090754?
The molecular formula of RefChem:1090754 is C28H24N4O4.
What is the molecular weight of RefChem:1090754?
The molecular weight of RefChem:1090754 is 480.18 g/mol.
Where can I buy RefChem:1090754?
You can request a quote for RefChem:1090754 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1090754?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1090754 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.