3-(2,5-dimethylanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(2,5-dimethylanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
3-(2,5-dimethylanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E959-0930 |
| Compound Name: | 3-(2,5-dimethylanilino)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 331.41 |
| Molecular Formula: | C22 H21 N O2 |
| Smiles: | Cc1ccc(C)c(c1)NC1=C(C(C1=O)=O)c1ccc2CCCCc2c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8998 |
| logD: | 4.8998 |
| logSw: | -4.5723 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.117 |
| InChI Key: | YRDKFKMMMCANIS-UHFFFAOYSA-N |