4-({[2-(cyclopentylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)-N-[(furan-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-({[2-(cyclopentylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)-N-[(furan-2-yl)methyl]benzamide
4-({[2-(cyclopentylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)-N-[(furan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | C804-0553 |
| Compound Name: | 4-({[2-(cyclopentylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}methyl)-N-[(furan-2-yl)methyl]benzamide |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C22 H23 N3 O4 |
| Smiles: | C1CCC(C1)NC1=C(C(C1=O)=O)NCc1ccc(cc1)C(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3865 |
| logD: | 2.3783 |
| logSw: | -2.6911 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.175 |
| InChI Key: | XVIIMKSXMXYRCW-UHFFFAOYSA-N |