5-butyl-3-(2-hydroxy-4-methoxyphenyl)-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Chemical Structure Depiction of
5-butyl-3-(2-hydroxy-4-methoxyphenyl)-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
5-butyl-3-(2-hydroxy-4-methoxyphenyl)-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Compound characteristics
| Compound ID: | 8013-5810 |
| Compound Name: | 5-butyl-3-(2-hydroxy-4-methoxyphenyl)-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C22 H30 N2 O6 |
| Smiles: | CCCCN1C(C2C(C1=O)C(CC(C)C)(C(O)=O)NC2c1ccc(cc1O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7865 |
| logD: | 0.4684 |
| logSw: | -3.0736 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.785 |
| InChI Key: | APXRCPCJZBJNDW-UHFFFAOYSA-N |