N-(3,5-dimethoxyphenyl)-4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)benzamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)benzamide
N-(3,5-dimethoxyphenyl)-4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)benzamide
Compound characteristics
| Compound ID: | C804-0664 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-4-({[3,4-dioxo-2-(piperidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)benzamide |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C25 H27 N3 O5 |
| Smiles: | COc1cc(cc(c1)OC)NC(c1ccc(CNC2=C(C(C2=O)=O)N2CCCCC2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2249 |
| logD: | 3.2173 |
| logSw: | -3.5112 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.037 |
| InChI Key: | GBMRSMOBDQJRCG-UHFFFAOYSA-N |