N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}propanamide
Chemical Structure Depiction of
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}propanamide
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}propanamide
Compound characteristics
| Compound ID: | D336-3562 |
| Compound Name: | N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}propanamide |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C18 H18 N2 O2 S2 |
| Smiles: | CCC(Nc1ccc2c(c1)sc(n2)SCCOc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5099 |
| logD: | 4.5099 |
| logSw: | -4.21 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.615 |
| InChI Key: | NFTIWGUAEJLTGN-UHFFFAOYSA-N |