![(6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione structure](/static/products/445/445462-51-1.png)
(6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
TL;DR: (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione (CAS 445462-51-1) is a chemical compound with molecular formula C23H20N2O4 and molecular weight 388.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10S,11R,15S,16R)-16-acetyl-13-(4-methoxyphenyl)-1,13-diazatetracyclo[8.6.0.02,7.011,15]hexadeca-2,4,6,8-tetraene-12,14-dione
Also Known As: (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione, (6aS,6bR,9aS,10R)-10-Acetyl-8-(4-methoxy-phenyl)-6a,6b,9a,10-tetrahydro-pyrrolo[3',4':3,4]pyrrolo[1, 2-a]quinoline-7,9-dione
| Molecular Formula | C23H20N2O4 |
|---|---|
| Molecular Weight | 388.14 g/mol |
| LogP | 2.674 |
| Topological Polar Surface Area | 66.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.1423 |
| Heavy Atoms | 29 |
| Complexity | 1058.8025 |
Chemical Identifiers
| CAS Number | 445462-51-1 |
|---|---|
| SMILES | CC(=O)[C@H]1[C@@H]2[C@H]([C@H]3N1C4=CC=CC=C4C=C3)C(=O)N(C2=O)C5=CC=C(C=C5)OC |
Product Overview
(6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione (CAS 445462-51-1), with molecular formula C23H20N2O4 and molecular weight 388.14 g/mol. IUPAC: (10S,11R,15S,16R)-16-acetyl-13-(4-methoxyphenyl)-1,13-diazatetracyclo[8.6.0.02,7.011,15]hexadeca-2,4,6,8-tetraene-12,14-dione.
Chemical Property Profile of (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Property Insights of (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
The XLogP value of 2.674 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione. The TPSA of 66.92 Ų falls within the moderate polarity range, balancing permeability and solubility for (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-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, (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-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 5 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 (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
The CAS number of (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione is 445462-51-1.
What is the molecular formula of (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
The molecular formula of (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione is C23H20N2O4.
What is the molecular weight of (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione?
The molecular weight of (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione is 388.14 g/mol.
Where can I buy (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-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 (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-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 (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-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 (6aS,6bR,9aS,10R)-10-acetyl-8-(4-methoxyphenyl)-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.