5-benzyl-3-(5-bromo-2-hydroxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Chemical Structure Depiction of
5-benzyl-3-(5-bromo-2-hydroxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
5-benzyl-3-(5-bromo-2-hydroxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Compound characteristics
| Compound ID: | 8012-9497 |
| Compound Name: | 5-benzyl-3-(5-bromo-2-hydroxyphenyl)-1-methyl-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid |
| Molecular Weight: | 459.29 |
| Molecular Formula: | C21 H19 Br N2 O5 |
| Smiles: | CC1(C2C(C(c3cc(ccc3O)[Br])N1)C(N(Cc1ccccc1)C2=O)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.604 |
| logD: | 0.2553 |
| logSw: | -2.7982 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.384 |
| InChI Key: | URWVCMIOFGTMFO-UHFFFAOYSA-N |