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5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione structure
Fine Chemical

5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione

TL;DR: 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione (CAS 128099-87-6) is a chemical compound with molecular formula C17H12ClNO2 and molecular weight 297.05566 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

10-chloro-10-phenyl-1-azatricyclo[6.3.1.04,12]dodeca-4(12),5,7-triene-9,11-dione

Also Known As: 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione, AE-406/41056467, 10-chloro-10-phenyl-1-azatricyclo[6.3.1.04,12]dodeca-4(12),5,7-triene-9,11-dione

CAS Number
128099-87-6
Molecular Formula
C17H12ClNO2
Molecular Weight
297.05566 g/mol
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Technical Specifications

Molecular FormulaC17H12ClNO2
Molecular Weight297.05566 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)37.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass297.05566 Da
Heavy Atoms21
Complexity473.0
SMILESC1CN2C3=C1C=CC=C3C(=O)C(C2=O)(C4=CC=CC=C4)Cl
InChIKeyRUCTUGJXTDZHSO-UHFFFAOYSA-N

Chemical Property Profile of 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione

XLogP
3.2
TPSA (Topological Polar Surface Area)
37.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
21
Complexity
473.0
Exact Mass
297.05566
Monoisotopic Mass
297.05566
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 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione

The XLogP value of 3.2 indicates that 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione?

The CAS number of 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione is 128099-87-6.

What is the molecular formula of 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione?

The molecular formula of 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione is C17H12ClNO2.

What is the molecular weight of 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione?

The molecular weight of 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione is 297.05566 g/mol.

Where can I buy 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione?

You can request a quote for 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione?

Yes, CoreyChem provides custom synthesis services for 5-chloro-5-phenyl-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-4,6(5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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