3-{[2-(thiophen-2-yl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[2-(thiophen-2-yl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-{[2-(thiophen-2-yl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | K906-5013 |
| Compound Name: | 3-{[2-(thiophen-2-yl)ethyl]amino}-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 325.43 |
| Molecular Formula: | C19 H19 N O2 S |
| Smiles: | Cc1cc(C)c(cc1C)C1=C(C(C1=O)=O)NCCc1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.2217 |
| logD: | 4.2217 |
| logSw: | -4.2358 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.076 |
| InChI Key: | HGADADVEQWFYIV-UHFFFAOYSA-N |