3-hydroxy-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-hydroxy-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
3-hydroxy-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | G317-0562 |
| Compound Name: | 3-hydroxy-4-{[(thiophen-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 209.22 |
| Molecular Formula: | C9 H7 N O3 S |
| Smiles: | C(c1cccs1)NC1=C(C(C1=O)=O)O |
| Stereo: | ACHIRAL |
| logP: | 0.4734 |
| logD: | -4.1814 |
| logSw: | -1.8933 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.578 |
| InChI Key: | ZFBJCYFPLZFYSB-UHFFFAOYSA-N |