ethyl 4-{[3,4-dioxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-1-en-1-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[3,4-dioxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-1-en-1-yl]amino}benzoate
ethyl 4-{[3,4-dioxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-1-en-1-yl]amino}benzoate
Compound characteristics
| Compound ID: | E959-0936 |
| Compound Name: | ethyl 4-{[3,4-dioxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobut-1-en-1-yl]amino}benzoate |
| Molecular Weight: | 375.42 |
| Molecular Formula: | C23 H21 N O4 |
| Smiles: | CCOC(c1ccc(cc1)NC1=C(C(C1=O)=O)c1ccc2CCCCc2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1366 |
| logD: | 5.1339 |
| logSw: | -5.04 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.569 |
| InChI Key: | NZFCGTMPNOLOPU-UHFFFAOYSA-N |