![2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide structure](/static/products/101/1014068-70-2.png)
2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide
TL;DR: 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide (CAS 1014068-70-2) is a chemical compound with molecular formula C22H17F3N4O4 and molecular weight 458.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1S,3R,3aR,6aS)-2',4,6-trioxo-5-[2-(trifluoromethyl)phenyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-1-yl]acetamide
Also Known As: 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide, 2-[(1S,3R,3aR,6aS)-2',4,6-trioxo-5-[2-(trifluoromethyl)phenyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-1-yl]acetamide, 2-{(3R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-[2-(trifluoromethyl)phenyl]-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}acetamide
| Molecular Formula | C22H17F3N4O4 |
|---|---|
| Molecular Weight | 458.12 g/mol |
| LogP | 1.5058 |
| Topological Polar Surface Area | 121.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 458.12018 |
| Heavy Atoms | 33 |
| Complexity | 1230.1168 |
Chemical Identifiers
| CAS Number | 1014068-70-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)[C@]3([C@H]4[C@@H]([C@@H](N3)CC(=O)N)C(=O)N(C4=O)C5=CC=CC=C5C(F)(F)F)C(=O)N2 |
Product Overview
2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide (CAS 1014068-70-2), with molecular formula C22H17F3N4O4 and molecular weight 458.12 g/mol. IUPAC: 2-[(1S,3R,3aR,6aS)-2',4,6-trioxo-5-[2-(trifluoromethyl)phenyl]spiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-1-yl]acetamide.
Chemical Property Profile of 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide
Property Insights of 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide
The XLogP value of 1.5058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide. The TPSA of 121.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide. Following Lipinski's Rule of Five, 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide has 3 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 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide?
The CAS number of 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide is 1014068-70-2.
What is the molecular formula of 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide?
The molecular formula of 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide is C22H17F3N4O4.
What is the molecular weight of 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide?
The molecular weight of 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide is 458.12 g/mol.
Where can I buy 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide?
You can request a quote for 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((1'R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-(2-(trifluoromethyl)phenyl)-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.