3-(4-chlorophenyl)-4-[(3-methoxypropyl)amino]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-[(3-methoxypropyl)amino]cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-[(3-methoxypropyl)amino]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0148 |
| Compound Name: | 3-(4-chlorophenyl)-4-[(3-methoxypropyl)amino]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 279.72 |
| Molecular Formula: | C14 H14 Cl N O3 |
| Smiles: | COCCCNC1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.2052 |
| logD: | 2.2052 |
| logSw: | -3.2243 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.672 |
| InChI Key: | VBHINLFGQYWNLH-UHFFFAOYSA-N |