3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E959-0885 |
| Compound Name: | 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C24 H25 N O4 |
| Smiles: | COc1ccc(CCNC2=C(C(C2=O)=O)c2ccc3CCCCc3c2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.7212 |
| logD: | 3.7212 |
| logSw: | -3.9532 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.239 |
| InChI Key: | KXAQMOGFYXLRIE-UHFFFAOYSA-N |