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2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione structure
Fine Chemical

2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione

TL;DR: 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione (CAS 1024248-64-3) is a chemical compound with molecular formula C22H17Cl2FN2O3 and molecular weight 446.06003 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione

Also Known As: 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione, 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,8bH)-dione, 2-(2,3-dichlorophenyl)-4-[(4-fluorophenyl)carbonyl]hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione

CAS Number
1024248-64-3
Molecular Formula
C22H17Cl2FN2O3
Molecular Weight
446.06003 g/mol
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Technical Specifications

Molecular FormulaC22H17Cl2FN2O3
Molecular Weight446.06003 g/mol
XLogP3.9
Topological Polar Surface Area (TPSA)57.7 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds3
Exact Mass446.06003 Da
Heavy Atoms30
Complexity744.0
SMILESC1CC2C3C(C(N2C1)C(=O)C4=CC=C(C=C4)F)C(=O)N(C3=O)C5=C(C(=CC=C5)Cl)Cl
InChIKeyTYBYAPIGYJYMEO-UHFFFAOYSA-N

Chemical Property Profile of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione

XLogP
3.9
TPSA (Topological Polar Surface Area)
57.7
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
3
Heavy Atoms
30
Complexity
744.0
Exact Mass
446.06003
Monoisotopic Mass
446.06003
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione

The XLogP value of 3.9 indicates that 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-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

What is the CAS number of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?

The CAS number of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione is 1024248-64-3.

What is the molecular formula of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?

The molecular formula of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione is C22H17Cl2FN2O3.

What is the molecular weight of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?

The molecular weight of 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione is 446.06003 g/mol.

Where can I buy 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?

You can request a quote for 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-4,6,7,8,8a,8b-hexahydro-3aH-pyrrolo[3,4-a]pyrrolizine-1,3-dione?

Yes, CoreyChem provides custom synthesis services for 2-(2,3-dichlorophenyl)-4-(4-fluorobenzoyl)-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.

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