methyl 2-({3,4-dioxo-2-[4-(propan-2-yl)phenyl]cyclobut-1-en-1-yl}amino)benzoate
Chemical Structure Depiction of
methyl 2-({3,4-dioxo-2-[4-(propan-2-yl)phenyl]cyclobut-1-en-1-yl}amino)benzoate
methyl 2-({3,4-dioxo-2-[4-(propan-2-yl)phenyl]cyclobut-1-en-1-yl}amino)benzoate
Compound characteristics
| Compound ID: | E511-0803 |
| Compound Name: | methyl 2-({3,4-dioxo-2-[4-(propan-2-yl)phenyl]cyclobut-1-en-1-yl}amino)benzoate |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C21 H19 N O4 |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C(C1=O)=O)Nc1ccccc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.569 |
| logD: | 3.7643 |
| logSw: | -4.4846 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.37 |
| InChI Key: | FTRVJPNILPDHMX-UHFFFAOYSA-N |