![(3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone structure](/static/products/459/459154-69-9.png)
(3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone
TL;DR: (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone (CAS 459154-69-9) is a chemical compound with molecular formula C24H16Cl2N2O4 and molecular weight 466.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,10-bis(3-chlorophenyl)-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone
Also Known As: (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone, 2,6-bis(3-chlorophenyl)hexahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone
| Molecular Formula | C24H16Cl2N2O4 |
|---|---|
| Molecular Weight | 466.05 g/mol |
| LogP | 3.7206 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 466.0487 |
| Heavy Atoms | 32 |
| Complexity | 1118.5653 |
Chemical Identifiers
| CAS Number | 459154-69-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)N2C(=O)C3C4C=CC(C3C2=O)C5C4C(=O)N(C5=O)C6=CC(=CC=C6)Cl |
Product Overview
(3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone (CAS 459154-69-9), with molecular formula C24H16Cl2N2O4 and molecular weight 466.05 g/mol. IUPAC: 4,10-bis(3-chlorophenyl)-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradec-13-ene-3,5,9,11-tetrone.
Chemical Property Profile of (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone
Property Insights of (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone
The XLogP value of 3.7206 indicates that (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone. Following Lipinski's Rule of Five, (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone has 0 hydrogen bond donor(s) and 4 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 (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone?
The CAS number of (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone is 459154-69-9.
What is the molecular formula of (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone?
The molecular formula of (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone is C24H16Cl2N2O4.
What is the molecular weight of (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone?
The molecular weight of (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone is 466.05 g/mol.
Where can I buy (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone?
You can request a quote for (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone?
Yes, KEHONG BIO provides custom synthesis services for (3aR,4R,8S,8aS)-2,6-bis(3-chlorophenyl)-4,4a,8,8a-tetrahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,3aH,6H,7aH)-tetraone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.