N-(2-ethoxyphenyl)-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
N-(2-ethoxyphenyl)-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
Compound characteristics
| Compound ID: | C852-0450 |
| Compound Name: | N-(2-ethoxyphenyl)-4-({[2-(4-methylpiperidin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C26 H29 N3 O4 |
| Smiles: | CCOc1ccccc1NC(c1ccc(CNC2=C(C(C2=O)=O)N2CCC(C)CC2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7891 |
| logD: | 3.7836 |
| logSw: | -3.9312 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.462 |
| InChI Key: | SKZRULSNSINPCE-UHFFFAOYSA-N |