N-benzyl-4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-methylbenzamide
Chemical Structure Depiction of
N-benzyl-4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-methylbenzamide
N-benzyl-4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-methylbenzamide
Compound characteristics
| Compound ID: | C906-0029 |
| Compound Name: | N-benzyl-4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-methylbenzamide |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C24 H25 N3 O3 |
| Smiles: | CN(Cc1ccccc1)C(c1ccc(CNC2=C(C(C2=O)=O)N2CCCC2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6964 |
| logD: | 2.691 |
| logSw: | -2.9667 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.375 |
| InChI Key: | WFWGIQZUUZVBEL-UHFFFAOYSA-N |