4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-(3-methylphenyl)benzamide
Chemical Structure Depiction of
4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-(3-methylphenyl)benzamide
4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-(3-methylphenyl)benzamide
Compound characteristics
| Compound ID: | C906-0198 |
| Compound Name: | 4-({[3,4-dioxo-2-(pyrrolidin-1-yl)cyclobut-1-en-1-yl]amino}methyl)-N-(3-methylphenyl)benzamide |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C23 H23 N3 O3 |
| Smiles: | Cc1cccc(c1)NC(c1ccc(CNC2=C(C(C2=O)=O)N2CCCC2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1672 |
| logD: | 3.1618 |
| logSw: | -3.2112 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.316 |
| InChI Key: | HSDYZYZKUYIUAM-UHFFFAOYSA-N |