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3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione structure
Fine Chemical

3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

TL;DR: 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione (CAS 1022789-64-5) is a chemical compound with molecular formula C27H25N3O8 and molecular weight 519.1642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

Also Known As: 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione, 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione

CAS Number
1022789-64-5
Molecular Formula
C27H25N3O8
Molecular Weight
519.1642 g/mol
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Technical Specifications

Molecular FormulaC27H25N3O8
Molecular Weight519.1642 g/mol
XLogP4.3
Topological Polar Surface Area (TPSA)134.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors9
Rotatable Bonds7
Exact Mass519.1642 Da
Heavy Atoms38
Complexity875.0
SMILESCCCOC1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC(=C(C=C5)O)OC
InChIKeyIKQUMOKDPCFEJQ-UHFFFAOYSA-N

Chemical Property Profile of 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

XLogP
4.3
TPSA (Topological Polar Surface Area)
134.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
9
Rotatable Bonds
7
Heavy Atoms
38
Complexity
875.0
Exact Mass
519.1642
Monoisotopic Mass
519.1642
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-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione

The XLogP value of 4.3 indicates that 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione. Following Lipinski's Rule of Five, 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?

The CAS number of 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is 1022789-64-5.

What is the molecular formula of 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?

The molecular formula of 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is C27H25N3O8.

What is the molecular weight of 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?

The molecular weight of 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione is 519.1642 g/mol.

Where can I buy 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?

You can request a quote for 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione?

Yes, CoreyChem provides custom synthesis services for 3-(4-hydroxy-3-methoxyphenyl)-2-(3-nitrophenyl)-5-(4-propoxyphenyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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