3-(5-bromo-2-hydroxyphenyl)-5-butyl-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Chemical Structure Depiction of
3-(5-bromo-2-hydroxyphenyl)-5-butyl-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
3-(5-bromo-2-hydroxyphenyl)-5-butyl-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Compound characteristics
| Compound ID: | 8014-1061 |
| Compound Name: | 3-(5-bromo-2-hydroxyphenyl)-5-butyl-1-(2-methylpropyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid |
| Molecular Weight: | 467.36 |
| Molecular Formula: | C21 H27 Br N2 O5 |
| Smiles: | CCCCN1C(C2C(C1=O)C(CC(C)C)(C(O)=O)NC2c1cc(ccc1O)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4768 |
| logD: | 1.1587 |
| logSw: | -3.4156 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.241 |
| InChI Key: | GSEQTUNUCZMITJ-UHFFFAOYSA-N |