4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide
TL;DR: 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide (CAS 445226-24-4) is a chemical compound with molecular formula C21H20N2O3 and molecular weight 348.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-phenylbenzamide
Also Known As: 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide, 4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-phenyl-benzamide, 4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-phenylbenzamide
| Molecular Formula | C21H20N2O3 |
|---|---|
| Molecular Weight | 348.15 g/mol |
| LogP | 3.6185 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.1474 |
| Heavy Atoms | 26 |
| Complexity | 821.3197 |
Chemical Identifiers
| CAS Number | 445226-24-4 |
|---|---|
| SMILES | C1CCC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4 |
Product Overview
4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide (CAS 445226-24-4), with molecular formula C21H20N2O3 and molecular weight 348.15 g/mol. IUPAC: 4-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-phenylbenzamide.
Chemical Property Profile of 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide
Property Insights of 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide
The XLogP value of 3.6185 indicates that 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide. Following Lipinski's Rule of Five, 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide has 1 hydrogen bond donor(s) and 3 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 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide?
The CAS number of 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide is 445226-24-4.
What is the molecular formula of 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide?
The molecular formula of 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide is C21H20N2O3.
What is the molecular weight of 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide?
The molecular weight of 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide is 348.15 g/mol.
Where can I buy 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide?
You can request a quote for 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-dioxooctahydro-2H-isoindol-2-yl)-N-phenylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.