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4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide structure
Fine Chemical

4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide

TL;DR: 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide (CAS 1212083-76-5) is a chemical compound with molecular formula C25H21N3O3 and molecular weight 411.1583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide

Also Known As: 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide, (S)-N-benzyl-4-(1,3-dioxo-10,10a-dihydroimidazo[1,5-b]isoquinolin-2(1H,3H,5H)-yl)benzamide, N-benzyl-4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]benzamide

CAS Number
1212083-76-5
Molecular Formula
C25H21N3O3
Molecular Weight
411.1583 g/mol
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Technical Specifications

Molecular FormulaC25H21N3O3
Molecular Weight411.1583 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)69.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass411.1583 Da
Heavy Atoms31
Complexity696.0
SMILESC1[C@H]2C(=O)N(C(=O)N2CC3=CC=CC=C31)C4=CC=C(C=C4)C(=O)NCC5=CC=CC=C5
InChIKeyVXMOWYJXXNCQQI-QFIPXVFZSA-N

Chemical Property Profile of 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide

XLogP
3.2
TPSA (Topological Polar Surface Area)
69.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
31
Complexity
696.0
Exact Mass
411.1583
Monoisotopic Mass
411.1583
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 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide

The XLogP value of 3.2 indicates that 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide. Following Lipinski's Rule of Five, 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide 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

What is the CAS number of 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide?

The CAS number of 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide is 1212083-76-5.

What is the molecular formula of 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide?

The molecular formula of 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide is C25H21N3O3.

What is the molecular weight of 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide?

The molecular weight of 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide is 411.1583 g/mol.

Where can I buy 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide?

You can request a quote for 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide?

Yes, CoreyChem provides custom synthesis services for 4-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-benzylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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