![3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide structure](/static/products/101/1014091-64-5.png)
3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide
TL;DR: 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide (CAS 1014091-64-5) is a chemical compound with molecular formula C22H19FN4O4 and molecular weight 422.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1S,3R,3aR,6aS)-5-(4-fluorophenyl)-2',4,6-trioxospiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-1-yl]propanamide
Also Known As: 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide, 3-[(1S,3R,3aR,6aS)-5-(4-fluorophenyl)-2',4,6-trioxospiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-1-yl]propanamide
| Molecular Formula | C22H19FN4O4 |
|---|---|
| Molecular Weight | 422.14 g/mol |
| LogP | 1.0162 |
| Topological Polar Surface Area | 121.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.13904 |
| Heavy Atoms | 31 |
| Complexity | 1134.5858 |
Chemical Identifiers
| CAS Number | 1014091-64-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)[C@]3([C@H]4[C@@H]([C@@H](N3)CCC(=O)N)C(=O)N(C4=O)C5=CC=C(C=C5)F)C(=O)N2 |
Product Overview
3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide (CAS 1014091-64-5), with molecular formula C22H19FN4O4 and molecular weight 422.14 g/mol. IUPAC: 3-[(1S,3R,3aR,6aS)-5-(4-fluorophenyl)-2',4,6-trioxospiro[1,2,3a,6a-tetrahydropyrrolo[3,4-c]pyrrole-3,3'-1H-indole]-1-yl]propanamide.
Chemical Property Profile of 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide
Property Insights of 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide
The XLogP value of 1.0162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide. The TPSA of 121.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide. Following Lipinski's Rule of Five, 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide 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 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide?
The CAS number of 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide is 1014091-64-5.
What is the molecular formula of 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide?
The molecular formula of 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide is C22H19FN4O4.
What is the molecular weight of 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide?
The molecular weight of 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide is 422.14 g/mol.
Where can I buy 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide?
You can request a quote for 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-((1'R,3'S,3a'S,6a'R)-5'-(4-fluorophenyl)-2,4',6'-trioxo-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.