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(3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione structure
Fine Chemical

(3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione

TL;DR: (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione (CAS 1212381-29-7) 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.

(3aS,6aS)-3-(4-methoxyphenyl)-5-(4-methylphenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione

Also Known As: (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione, (3aS,6aS)-3-(4-methoxyphenyl)-5-(4-methylphenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione, (3aS,6aS)-3-(4-methoxyphenyl)-5-(4-methylphenyl)-1-phenyl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione

CAS Number
1212381-29-7
Molecular Formula
C25H21N3O3
Molecular Weight
411.1583 g/mol
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Technical Specifications

Molecular FormulaC25H21N3O3
Molecular Weight411.1583 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)62.2 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors5
Rotatable Bonds4
Exact Mass411.1583 Da
Heavy Atoms31
Complexity716.0
SMILESCC1=CC=C(C=C1)N2C(=O)[C@H]3[C@@H](C2=O)N(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5
InChIKeyLDLNTYIVGRZWTB-GGAORHGYSA-N

Chemical Property Profile of (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione

XLogP
4.7
TPSA (Topological Polar Surface Area)
62.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
4
Heavy Atoms
31
Complexity
716.0
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 (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione

The XLogP value of 4.7 indicates that (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione. Following Lipinski's Rule of Five, (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione?

The CAS number of (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is 1212381-29-7.

What is the molecular formula of (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione?

The molecular formula of (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is C25H21N3O3.

What is the molecular weight of (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione?

The molecular weight of (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione is 411.1583 g/mol.

Where can I buy (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione?

You can request a quote for (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione?

Yes, CoreyChem provides custom synthesis services for (3aS,6aS)-3-(4-methoxyphenyl)-1-phenyl-5-(p-tolyl)-1,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(3aH,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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