3-(butylamino)-4-phenylcyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(butylamino)-4-phenylcyclobut-3-ene-1,2-dione
3-(butylamino)-4-phenylcyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0472 |
| Compound Name: | 3-(butylamino)-4-phenylcyclobut-3-ene-1,2-dione |
| Molecular Weight: | 229.28 |
| Molecular Formula: | C14 H15 N O2 |
| Smiles: | CCCCNC1=C(C(C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6257 |
| logD: | 2.6257 |
| logSw: | -2.9664 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.33 |
| InChI Key: | DCDWJYPYUGGVFP-UHFFFAOYSA-N |