ethyl 4-{3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate
ethyl 4-{3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K781-8124 |
| Compound Name: | ethyl 4-{3-[(4-chloro-2-fluorophenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate |
| Molecular Weight: | 487.91 |
| Molecular Formula: | C20 H20 Cl F2 N3 O5 S |
| Smiles: | CCOC(N1CCN(CC1)S(c1ccc(c(c1)C(Nc1ccc(cc1F)[Cl])=O)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8946 |
| logD: | 2.4106 |
| logSw: | -4.3901 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.123 |
| InChI Key: | ZPGBJOCPXQKGLU-UHFFFAOYSA-N |