3-(3,5-dimethylanilino)-4-ethoxycyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3,5-dimethylanilino)-4-ethoxycyclobut-3-ene-1,2-dione
3-(3,5-dimethylanilino)-4-ethoxycyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | G317-0126 |
| Compound Name: | 3-(3,5-dimethylanilino)-4-ethoxycyclobut-3-ene-1,2-dione |
| Molecular Weight: | 245.28 |
| Molecular Formula: | C14 H15 N O3 |
| Smiles: | CCOC1=C(C(C1=O)=O)Nc1cc(C)cc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.7555 |
| logD: | 2.7546 |
| logSw: | -2.8279 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.607 |
| InChI Key: | FGZWNMSRNZEWFQ-UHFFFAOYSA-N |