![2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione structure](/static/products/100/1005082-75-6.png)
2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione
TL;DR: 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione (CAS 1005082-75-6) is a chemical compound with molecular formula C24H21ClN2O4 and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione
Also Known As: 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione, 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,8bH)-dione, 2-(4-acetylphenyl)-4-[(4-chlorophenyl)carbonyl]hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
| Molecular Formula | C24H21ClN2O4 |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.119 |
| Heavy Atoms | 31 |
| Complexity | 784.0 |
Chemical Identifiers
| CAS Number | 1005082-75-6 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)N2C(=O)C3C4CCCN4C(C3C2=O)C(=O)C5=CC=C(C=C5)Cl |
| InChIKey | SBHPYWUIZUXOQZ-UHFFFAOYSA-N |
Product Overview
2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione (CAS 1005082-75-6), with molecular formula C24H21ClN2O4 and molecular weight 436.12 g/mol. IUPAC: 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione.
Chemical Property Profile of 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione
Property Insights of 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione. Following Lipinski's Rule of Five, 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione 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 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?
The CAS number of 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione is 1005082-75-6.
What is the molecular formula of 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?
The molecular formula of 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione is C24H21ClN2O4.
What is the molecular weight of 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?
The molecular weight of 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione is 436.12 g/mol.
Where can I buy 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?
You can request a quote for 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-acetylphenyl)-4-(4-chlorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.