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3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione structure
Fine Chemical

3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione

TL;DR: 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione (CAS 1023266-04-7) is a chemical compound with molecular formula C29H34N2O5 and molecular weight 490.24677 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(2,5-diethyl-3,4-dihydropyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

Also Known As: 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 3-(2,5-diethyl-3,4-dihydropyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

CAS Number
1023266-04-7
Molecular Formula
C29H34N2O5
Molecular Weight
490.24677 g/mol
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Technical Specifications

Molecular FormulaC29H34N2O5
Molecular Weight490.24677 g/mol
XLogP5.5
Topological Polar Surface Area (TPSA)68.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds8
Exact Mass490.24677 Da
Heavy Atoms36
Complexity832.0
SMILESCCCOC1=CC=C(C=C1)N2C(=O)C3C(C2=O)ON(C3C4(CCC(=CO4)CC)CC)C5=CC=CC=C5
InChIKeyQJZAAVNLNNRBFQ-UHFFFAOYSA-N

Chemical Property Profile of 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione

XLogP
5.5
TPSA (Topological Polar Surface Area)
68.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
8
Heavy Atoms
36
Complexity
832.0
Exact Mass
490.24677
Monoisotopic Mass
490.24677
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 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione

The XLogP value of 5.5 indicates that 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione. Following Lipinski's Rule of Five, 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione?

The CAS number of 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione is 1023266-04-7.

What is the molecular formula of 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione?

The molecular formula of 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione is C29H34N2O5.

What is the molecular weight of 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione?

The molecular weight of 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione is 490.24677 g/mol.

Where can I buy 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione?

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Yes, CoreyChem provides custom synthesis services for 3-(2,5-diethyl-3,4-dihydro-2H-pyran-2-yl)-2-phenyl-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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