ethyl 4-{5-[(2-chlorobenzene-1-sulfinyl)methyl]furan-2-carbonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{5-[(2-chlorobenzene-1-sulfinyl)methyl]furan-2-carbonyl}piperazine-1-carboxylate
ethyl 4-{5-[(2-chlorobenzene-1-sulfinyl)methyl]furan-2-carbonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | E535-2014 |
| Compound Name: | ethyl 4-{5-[(2-chlorobenzene-1-sulfinyl)methyl]furan-2-carbonyl}piperazine-1-carboxylate |
| Molecular Weight: | 424.9 |
| Molecular Formula: | C19 H21 Cl N2 O5 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc(CS(c2ccccc2[Cl])=O)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6147 |
| logD: | 2.6147 |
| logSw: | -3.038 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.649 |
| InChI Key: | TVRYBXRKZUYBEP-UHFFFAOYSA-N |