N-(3,4-dimethoxyphenyl)-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
N-(3,4-dimethoxyphenyl)-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide
Compound characteristics
| Compound ID: | C804-0889 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-4-({[2-(morpholin-4-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)benzamide |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C24 H25 N3 O6 |
| Smiles: | COc1ccc(cc1OC)NC(c1ccc(CNC2=C(C(C2=O)=O)N2CCOCC2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4621 |
| logD: | 1.4567 |
| logSw: | -2.3202 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.119 |
| InChI Key: | MPZQIFCUDLOCRA-UHFFFAOYSA-N |