ethyl 4-(5-{[(3-chlorophenyl)methanesulfinyl]methyl}furan-2-carbonyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(5-{[(3-chlorophenyl)methanesulfinyl]methyl}furan-2-carbonyl)piperazine-1-carboxylate
ethyl 4-(5-{[(3-chlorophenyl)methanesulfinyl]methyl}furan-2-carbonyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | E535-6313 |
| Compound Name: | ethyl 4-(5-{[(3-chlorophenyl)methanesulfinyl]methyl}furan-2-carbonyl)piperazine-1-carboxylate |
| Molecular Weight: | 438.93 |
| Molecular Formula: | C20 H23 Cl N2 O5 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc(CS(Cc2cccc(c2)[Cl])=O)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9937 |
| logD: | 2.9937 |
| logSw: | -3.4033 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.281 |
| InChI Key: | ZHCCUNCIEKCBCZ-UHFFFAOYSA-N |