{1-[(2-chlorophenyl)methyl]-5'-(4-methoxyphenyl)-2,4',6'-trioxo-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}acetic acid
Chemical Structure Depiction of
{1-[(2-chlorophenyl)methyl]-5'-(4-methoxyphenyl)-2,4',6'-trioxo-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}acetic acid
{1-[(2-chlorophenyl)methyl]-5'-(4-methoxyphenyl)-2,4',6'-trioxo-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}acetic acid
Compound characteristics
| Compound ID: | 8014-1921 |
| Compound Name: | {1-[(2-chlorophenyl)methyl]-5'-(4-methoxyphenyl)-2,4',6'-trioxo-1,2,3',3'a,4',5',6',6'a-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}acetic acid |
| Molecular Weight: | 545.98 |
| Molecular Formula: | C29 H24 Cl N3 O6 |
| Smiles: | COc1ccc(cc1)N1C(C2C(C1=O)C1(C(N(Cc3ccccc3[Cl])c3ccccc13)=O)NC2CC(O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.357 |
| logD: | -0.2402 |
| logSw: | -3.1076 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.931 |
| InChI Key: | UWGGBQRXBXVNRS-UHFFFAOYSA-N |