N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}furan-2-carboxamide
Chemical Structure Depiction of
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}furan-2-carboxamide
N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}furan-2-carboxamide
Compound characteristics
| Compound ID: | D336-3557 |
| Compound Name: | N-{2-[(2-phenoxyethyl)sulfanyl]-1,3-benzothiazol-6-yl}furan-2-carboxamide |
| Molecular Weight: | 396.49 |
| Molecular Formula: | C20 H16 N2 O3 S2 |
| Smiles: | C(CSc1nc2ccc(cc2s1)NC(c1ccco1)=O)Oc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9045 |
| logD: | 4.9043 |
| logSw: | -4.8456 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.136 |
| InChI Key: | XLLQHXNITVYOAP-UHFFFAOYSA-N |