ethyl 4-{3-[(3-chloro-4-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[(3-chloro-4-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate
ethyl 4-{3-[(3-chloro-4-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | K781-8187 |
| Compound Name: | ethyl 4-{3-[(3-chloro-4-methylphenyl)carbamoyl]-4-fluorobenzene-1-sulfonyl}piperazine-1-carboxylate |
| Molecular Weight: | 483.94 |
| Molecular Formula: | C21 H23 Cl F N3 O5 S |
| Smiles: | CCOC(N1CCN(CC1)S(c1ccc(c(c1)C(Nc1ccc(C)c(c1)[Cl])=O)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4647 |
| logD: | 4.2569 |
| logSw: | -4.6118 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.821 |
| InChI Key: | ZXINYZPLAYFISD-UHFFFAOYSA-N |