3-(4-chlorophenyl)-4-{[2-(3-methylthiophen-2-yl)ethyl]amino}cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-{[2-(3-methylthiophen-2-yl)ethyl]amino}cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-{[2-(3-methylthiophen-2-yl)ethyl]amino}cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0199 |
| Compound Name: | 3-(4-chlorophenyl)-4-{[2-(3-methylthiophen-2-yl)ethyl]amino}cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 331.82 |
| Molecular Formula: | C17 H14 Cl N O2 S |
| Smiles: | Cc1ccsc1CCNC1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8691 |
| logD: | 3.8691 |
| logSw: | -4.3902 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.076 |
| InChI Key: | WBPUBCKVEIMBPN-UHFFFAOYSA-N |