![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](/static/products/1217/1217657-94-7.webp)
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 454.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C26H18N2O6 |
|---|---|
| Molecular Weight | 454.12 g/mol |
| LogP | 3.4066 |
| Topological Polar Surface Area | 89.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 454.1165 |
| Heavy Atoms | 34 |
| Complexity | 1394.0321 |
Chemical Identifiers
| CAS Number | 1217657-94-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)N3C(=O)C4C(C3=O)C(N5C4C6=CC=CC=C6C=C5)C(=O)C7=CC=CO7 |
Product Overview
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), with molecular formula C26H18N2O6 and molecular weight 454.12 g/mol. IUPAC: 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.
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
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 3.4066 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 89.29 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
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 454.12 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO 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, KEHONG BIO 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.