1-benzyl-3-(4-bromophenyl)-5-(4-ethoxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Chemical Structure Depiction of
1-benzyl-3-(4-bromophenyl)-5-(4-ethoxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
1-benzyl-3-(4-bromophenyl)-5-(4-ethoxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Compound characteristics
Compound ID: | C202-1232 |
Compound Name: | 1-benzyl-3-(4-bromophenyl)-5-(4-ethoxyphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid |
Molecular Weight: | 549.42 |
Molecular Formula: | C28 H25 Br N2 O5 |
Smiles: | CCOc1ccc(cc1)N1C(C2C(C1=O)C(Cc1ccccc1)(C(O)=O)NC2c1ccc(cc1)[Br])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.1394 |
logD: | 1.8485 |
logSw: | -4.2182 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.684 |
InChI Key: | FBWPDSZBJDSCHO-UHFFFAOYSA-N |