3-{[2-(3-methylthiophen-2-yl)ethyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[2-(3-methylthiophen-2-yl)ethyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
3-{[2-(3-methylthiophen-2-yl)ethyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E511-0992 |
| Compound Name: | 3-{[2-(3-methylthiophen-2-yl)ethyl]amino}-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 339.45 |
| Molecular Formula: | C20 H21 N O2 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C(C1=O)=O)NCCc1c(C)ccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.6125 |
| logD: | 4.6125 |
| logSw: | -4.2616 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.076 |
| InChI Key: | UKBNFVLIGWOHDA-UHFFFAOYSA-N |