ethyl 4-{[1-(4,4,4-trifluoro-3-oxobut-1-en-1-yl)prolyl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[1-(4,4,4-trifluoro-3-oxobut-1-en-1-yl)prolyl]amino}benzoate
ethyl 4-{[1-(4,4,4-trifluoro-3-oxobut-1-en-1-yl)prolyl]amino}benzoate
Compound characteristics
| Compound ID: | C373-0038 |
| Compound Name: | ethyl 4-{[1-(4,4,4-trifluoro-3-oxobut-1-en-1-yl)prolyl]amino}benzoate |
| Molecular Weight: | 384.35 |
| Molecular Formula: | C18 H19 F3 N2 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(C1CCCN1/C=C/C(C(F)(F)F)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5236 |
| logD: | 2.5232 |
| logSw: | -2.8661 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.171 |
| InChI Key: | SKPBUCTXMPEPMO-AWEZNQCLSA-N |