dimethyl 5-[3-(phenylsulfanyl)propanamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[3-(phenylsulfanyl)propanamido]benzene-1,3-dicarboxylate
dimethyl 5-[3-(phenylsulfanyl)propanamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y032-3808 |
| Compound Name: | dimethyl 5-[3-(phenylsulfanyl)propanamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C19 H19 N O5 S |
| Smiles: | COC(c1cc(cc(c1)NC(CCSc1ccccc1)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0661 |
| logD: | 4.066 |
| logSw: | -4.2267 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.464 |
| InChI Key: | NQRDSFRWUGLJRQ-UHFFFAOYSA-N |