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(10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione structure
Fine Chemical

(10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione

TL;DR: (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione (CAS 1212155-21-9) is a chemical compound with molecular formula C23H13F5N2O3 and molecular weight 460.08463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione

Also Known As: (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione, (10aS)-2-[3-(pentafluorophenoxy)phenyl]-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione, (S)-2-(3-(perfluorophenoxy)phenyl)-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione

CAS Number
1212155-21-9
Molecular Formula
C23H13F5N2O3
Molecular Weight
460.08463 g/mol
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Technical Specifications

Molecular FormulaC23H13F5N2O3
Molecular Weight460.08463 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)49.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors8
Rotatable Bonds3
Exact Mass460.08463 Da
Heavy Atoms33
Complexity758.0
SMILESC1[C@H]2C(=O)N(C(=O)N2CC3=CC=CC=C31)C4=CC(=CC=C4)OC5=C(C(=C(C(=C5F)F)F)F)F
InChIKeyAKIOAGPAMZAYNN-HNNXBMFYSA-N

Chemical Property Profile of (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione

XLogP
4.5
TPSA (Topological Polar Surface Area)
49.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
3
Heavy Atoms
33
Complexity
758.0
Exact Mass
460.08463
Monoisotopic Mass
460.08463
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 (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione

The XLogP value of 4.5 indicates that (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione?

The CAS number of (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione is 1212155-21-9.

What is the molecular formula of (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione?

The molecular formula of (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione is C23H13F5N2O3.

What is the molecular weight of (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione?

The molecular weight of (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione is 460.08463 g/mol.

Where can I buy (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione?

You can request a quote for (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione?

Yes, CoreyChem provides custom synthesis services for (10aS)-2-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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