3-{[(2-chlorophenyl)methyl]amino}-4-hydroxycyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[(2-chlorophenyl)methyl]amino}-4-hydroxycyclobut-3-ene-1,2-dione
3-{[(2-chlorophenyl)methyl]amino}-4-hydroxycyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | G317-0434 |
| Compound Name: | 3-{[(2-chlorophenyl)methyl]amino}-4-hydroxycyclobut-3-ene-1,2-dione |
| Molecular Weight: | 237.64 |
| Molecular Formula: | C11 H8 Cl N O3 |
| Smiles: | C(c1ccccc1[Cl])NC1=C(C(C1=O)=O)O |
| Stereo: | ACHIRAL |
| logP: | 1.2804 |
| logD: | -3.5302 |
| logSw: | -2.1627 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.559 |
| InChI Key: | JPMPYBOTQPMINI-UHFFFAOYSA-N |