3-phenyl-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-phenyl-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
3-phenyl-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0421 |
| Compound Name: | 3-phenyl-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 269.32 |
| Molecular Formula: | C15 H11 N O2 S |
| Smiles: | C(c1cccs1)NC1=C(C(C1=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6166 |
| logD: | 2.6166 |
| logSw: | -2.9225 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.235 |
| InChI Key: | XPRHRTDOXDPMLO-UHFFFAOYSA-N |