ethyl 3-{[1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]amino}benzoate
ethyl 3-{[1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | F828-0444 |
| Compound Name: | ethyl 3-{[1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonyl]amino}benzoate |
| Molecular Weight: | 417.46 |
| Molecular Formula: | C20 H20 F N3 O4 S |
| Smiles: | CCOC(c1cccc(c1)NS(c1c(C)nn(c2ccc(cc2)F)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8566 |
| logD: | 3.7809 |
| logSw: | -3.9527 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.06 |
| InChI Key: | MPBHVXCPISDWJO-UHFFFAOYSA-N |