3-ethyl 1,2-dimethyl 3-(3-oxopiperazin-2-ylidene)prop-1-ene-1,2,3-tricarboxylate
Chemical Structure Depiction of
3-ethyl 1,2-dimethyl 3-(3-oxopiperazin-2-ylidene)prop-1-ene-1,2,3-tricarboxylate
3-ethyl 1,2-dimethyl 3-(3-oxopiperazin-2-ylidene)prop-1-ene-1,2,3-tricarboxylate
Compound characteristics
| Compound ID: | 8020-0175 |
| Compound Name: | 3-ethyl 1,2-dimethyl 3-(3-oxopiperazin-2-ylidene)prop-1-ene-1,2,3-tricarboxylate |
| Molecular Weight: | 326.3 |
| Molecular Formula: | C14 H18 N2 O7 |
| Smiles: | CCOC(C(\C(=C/C(=O)OC)C(=O)OC)=C1/C(NCCN1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.362 |
| logD: | -0.4028 |
| logSw: | -0.5752 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.82 |
| InChI Key: | KDVFFLHOISOVLX-UHFFFAOYSA-N |