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10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione structure
Fine Chemical

10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione

TL;DR: 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione (CAS 1217657-94-7) is a chemical compound with molecular formula C26H18N2O6 and molecular weight 454.1165 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

14-(1,3-benzodioxol-5-yl)-11-(furan-2-carbonyl)-10,14-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-2,4,6,8-tetraene-13,15-dione

Also Known As: 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione, 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3a(2),4a(2):3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione, 10-(1,3-benzodioxol-5-yl)-8-(furan-2-ylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione

CAS Number
1217657-94-7
Molecular Formula
C26H18N2O6
Molecular Weight
454.1165 g/mol
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Technical Specifications

Molecular FormulaC26H18N2O6
Molecular Weight454.1165 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)89.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors7
Rotatable Bonds3
Exact Mass454.1165 Da
Heavy Atoms34
Complexity921.0
SMILESC1OC2=C(O1)C=C(C=C2)N3C(=O)C4C(C3=O)C(N5C4C6=CC=CC=C6C=C5)C(=O)C7=CC=CO7
InChIKeyTUQLARBEMWMAES-UHFFFAOYSA-N

Chemical Property Profile of 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione

XLogP
3.1
TPSA (Topological Polar Surface Area)
89.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
7
Rotatable Bonds
3
Heavy Atoms
34
Complexity
921.0
Exact Mass
454.1165
Monoisotopic Mass
454.1165
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 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione

The XLogP value of 3.1 indicates that 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione. Following Lipinski's Rule of Five, 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione?

The CAS number of 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione is 1217657-94-7.

What is the molecular formula of 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione?

The molecular formula of 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione is C26H18N2O6.

What is the molecular weight of 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione?

The molecular weight of 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione is 454.1165 g/mol.

Where can I buy 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione?

You can request a quote for 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione?

Yes, CoreyChem provides custom synthesis services for 10-(1,3-Benzodioxol-5-yl)-8-(2-furanylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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