3-(4-methylphenyl)-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-methylphenyl)-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
3-(4-methylphenyl)-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0156 |
| Compound Name: | 3-(4-methylphenyl)-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 283.35 |
| Molecular Formula: | C16 H13 N O2 S |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)NCc1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 3.1451 |
| logD: | 3.145 |
| logSw: | -3.2785 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.235 |
| InChI Key: | POVKZDPDCPIKAX-UHFFFAOYSA-N |