N-(3-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(3-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
N-(3-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y510-4399 |
| Compound Name: | N-(3-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}phenyl)adamantane-1-carboxamide |
| Molecular Weight: | 521.7 |
| Molecular Formula: | C28 H31 N3 O3 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(n2)SCC(Nc1cccc(c1)NC(C12CC3CC(CC(C3)C2)C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1643 |
| logD: | 7.1643 |
| logSw: | -5.6627 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.446 |
| InChI Key: | BSRKLIXUTFJHQS-UHFFFAOYSA-N |