propan-2-yl 4,4,4-trifluoro-2-{1-hydroxy-4-[(4-methylbenzene-1-sulfonyl)amino]naphthalen-2-yl}-3-oxobutanoate
Chemical Structure Depiction of
propan-2-yl 4,4,4-trifluoro-2-{1-hydroxy-4-[(4-methylbenzene-1-sulfonyl)amino]naphthalen-2-yl}-3-oxobutanoate
propan-2-yl 4,4,4-trifluoro-2-{1-hydroxy-4-[(4-methylbenzene-1-sulfonyl)amino]naphthalen-2-yl}-3-oxobutanoate
Compound characteristics
| Compound ID: | 2318-0569 |
| Compound Name: | propan-2-yl 4,4,4-trifluoro-2-{1-hydroxy-4-[(4-methylbenzene-1-sulfonyl)amino]naphthalen-2-yl}-3-oxobutanoate |
| Molecular Weight: | 509.5 |
| Molecular Formula: | C24 H22 F3 N O6 S |
| Smiles: | CC(C)OC(C(C(C(F)(F)F)=O)c1cc(c2ccccc2c1O)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3653 |
| logD: | 5.184 |
| logSw: | -5.3261 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.569 |
| InChI Key: | YPOSVSICFZOGQX-FQEVSTJZSA-N |