5'-(2-methoxyphenyl)-3'-methyl-1-(prop-2-yn-1-yl)-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Chemical Structure Depiction of
5'-(2-methoxyphenyl)-3'-methyl-1-(prop-2-yn-1-yl)-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
5'-(2-methoxyphenyl)-3'-methyl-1-(prop-2-yn-1-yl)-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Compound characteristics
| Compound ID: | 8015-9124 |
| Compound Name: | 5'-(2-methoxyphenyl)-3'-methyl-1-(prop-2-yn-1-yl)-3'a,6'a-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione |
| Molecular Weight: | 415.45 |
| Molecular Formula: | C24 H21 N3 O4 |
| Smiles: | CC1C2C(C(N(C2=O)c2ccccc2OC)=O)C2(C(N(CC#C)c3ccccc23)=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9221 |
| logD: | 1.922 |
| logSw: | -2.8182 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.976 |
| InChI Key: | KYKKMVPIPARHBG-UHFFFAOYSA-N |