methyl 1-acetyl-5-(4-ethoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 1-acetyl-5-(4-ethoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
methyl 1-acetyl-5-(4-ethoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 3849-0799 |
| Compound Name: | methyl 1-acetyl-5-(4-ethoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate |
| Molecular Weight: | 359.34 |
| Molecular Formula: | C17 H17 N3 O6 |
| Smiles: | CCOc1ccc(cc1)N1C(C2C(C1=O)N(C(C)=O)N=C2C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.3605 |
| logD: | 0.3591 |
| logSw: | -1.3766 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.952 |
| InChI Key: | IBWFFQADTMYRAT-UHFFFAOYSA-N |