![5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone structure](/static/products/100/1005103-63-8.png)
5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone
TL;DR: 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone (CAS 1005103-63-8) is a chemical compound with molecular formula C23H19FN2O4 and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-fluorophenyl)-1-propan-2-ylspiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
Also Known As: 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone, 5'-(4-fluorophenyl)-3'-isopropyl-3',3a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(5'H,6a'H)-tetraone, 5-(4-fluorophenyl)-1-propan-2-ylspiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone
| Molecular Formula | C23H19FN2O4 |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 406.13287 |
| Heavy Atoms | 30 |
| Complexity | 779.0 |
Chemical Identifiers
| CAS Number | 1005103-63-8 |
|---|---|
| SMILES | CC(C)C1C2C(C(=O)N(C2=O)C3=CC=C(C=C3)F)C4(N1)C(=O)C5=CC=CC=C5C4=O |
| InChIKey | WNJRJDCMWAWMBB-UHFFFAOYSA-N |
Product Overview
5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone (CAS 1005103-63-8), with molecular formula C23H19FN2O4 and molecular weight 406.13 g/mol. IUPAC: 5-(4-fluorophenyl)-1-propan-2-ylspiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,2'-indene]-1',3',4,6-tetrone.
Chemical Property Profile of 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone
Property Insights of 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone. Following Lipinski's Rule of Five, 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone has 1 hydrogen bond donor(s) and 6 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 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone?
The CAS number of 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone is 1005103-63-8.
What is the molecular formula of 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone?
The molecular formula of 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone is C23H19FN2O4.
What is the molecular weight of 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone?
The molecular weight of 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone is 406.13 g/mol.
Where can I buy 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone?
You can request a quote for 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone?
Yes, KEHONG BIO provides custom synthesis services for 5'-(4-fluorophenyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indene-2,1'-pyrrolo[3,4-c]pyrrole]-1,3,4',6'(3'H,5'H)-tetrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.