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3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione structure
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3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione

TL;DR: 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione (CAS 1022543-73-2) is a chemical compound with molecular formula C30H23N3O6 and molecular weight 521.1587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione

Also Known As: 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione, 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione, 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 8-(4-methoxyphenyl)-3-(3-nitrophenyl)-1,7-diphenyl-6-oxa-3,7-diazabicyclo[3.3.0]octane-2,4-dione

CAS Number
1022543-73-2
Molecular Formula
C30H23N3O6
Molecular Weight
521.1587 g/mol
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Technical Specifications

Molecular FormulaC30H23N3O6
Molecular Weight521.1587 g/mol
XLogP5.3
Topological Polar Surface Area (TPSA)105.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors7
Rotatable Bonds5
Exact Mass521.1587 Da
Heavy Atoms39
Complexity920.0
SMILESCOC1=CC=C(C=C1)C2C3(C(C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])ON2C5=CC=CC=C5)C6=CC=CC=C6
InChIKeyYRHBIPLZZXSQFR-UHFFFAOYSA-N

Chemical Property Profile of 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione

XLogP
5.3
TPSA (Topological Polar Surface Area)
105.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
7
Rotatable Bonds
5
Heavy Atoms
39
Complexity
920.0
Exact Mass
521.1587
Monoisotopic Mass
521.1587
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-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione

The XLogP value of 5.3 indicates that 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[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 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione. Following Lipinski's Rule of Five, 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?

The CAS number of 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione is 1022543-73-2.

What is the molecular formula of 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?

The molecular formula of 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione is C30H23N3O6.

What is the molecular weight of 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?

The molecular weight of 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione is 521.1587 g/mol.

Where can I buy 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?

You can request a quote for 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[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-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[3,4-d][1,2]oxazole-4,6-dione?

Yes, CoreyChem provides custom synthesis services for 3-(4-methoxyphenyl)-5-(3-nitrophenyl)-2,3a-diphenyl-3,6a-dihydropyrrolo[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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