ethyl 4-{[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl]amino}benzoate
ethyl 4-{[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl]amino}benzoate
Compound characteristics
| Compound ID: | K699-0057 |
| Compound Name: | ethyl 4-{[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl]amino}benzoate |
| Molecular Weight: | 359.38 |
| Molecular Formula: | C19 H21 N O6 |
| Smiles: | CCOC(c1ccc(cc1)NC=C1C(=O)OC2(CCCCC2)OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2644 |
| logD: | 2.5722 |
| logSw: | -3.3231 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.684 |
| InChI Key: | MQPIFLDFZUCYGW-UHFFFAOYSA-N |