![(6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione structure](/static/products/101/1013771-22-6.png)
(6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
TL;DR: (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione (CAS 1013771-22-6) 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.
(10R,11S,15R,16S)-13-(1,3-benzodioxol-5-yl)-16-(furan-2-carbonyl)-1,13-diazatetracyclo[8.6.0.02,7.011,15]hexadeca-2,4,6,8-tetraene-12,14-dione
Also Known As: (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione, (6aR,6bS,9aR,10S)-8-(benzo[d][1,3]dioxol-5-yl)-10-(furan-2-carbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
| Molecular Formula | C26H18N2O6 |
|---|---|
| Molecular Weight | 454.12 g/mol |
| LogP | 3.281 |
| 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 | 1013771-22-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)N3C(=O)[C@@H]4[C@H]5C=CC6=CC=CC=C6N5[C@@H]([C@@H]4C3=O)C(=O)C7=CC=CO7 |
Product Overview
(6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione (CAS 1013771-22-6), with molecular formula C26H18N2O6 and molecular weight 454.12 g/mol. IUPAC: (10R,11S,15R,16S)-13-(1,3-benzodioxol-5-yl)-16-(furan-2-carbonyl)-1,13-diazatetracyclo[8.6.0.02,7.011,15]hexadeca-2,4,6,8-tetraene-12,14-dione.
Chemical Property Profile of (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Property Insights of (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
The XLogP value of 3.281 indicates that (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-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 (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione. Following Lipinski's Rule of Five, (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-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 (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
The CAS number of (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione is 1013771-22-6.
What is the molecular formula of (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
The molecular formula of (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione is C26H18N2O6.
What is the molecular weight of (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
The molecular weight of (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione is 454.12 g/mol.
Where can I buy (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
You can request a quote for (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (6aR,6bS,9aR,10S)-8-(1,3-benzodioxol-5-yl)-10-(furan-2-ylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.