N-{[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-3-methylbutanamide
Chemical Structure Depiction of
N-{[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-3-methylbutanamide
N-{[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-3-methylbutanamide
Compound characteristics
| Compound ID: | 5167-2584 |
| Compound Name: | N-{[3-(1,3-benzothiazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-3-methylbutanamide |
| Molecular Weight: | 385.51 |
| Molecular Formula: | C19 H19 N3 O2 S2 |
| Smiles: | CC(C)CC(NC(Nc1ccc(c(c1)c1nc2ccccc2s1)O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3407 |
| logD: | 5.3404 |
| logSw: | -5.0588 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 59.295 |
| InChI Key: | CYPWLASRCKGKMF-UHFFFAOYSA-N |